N-benzyl-5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridin-2-amine;N,N-diethyl-5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridin-2-amine;5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridine-2-carbonitrile;N-(2-methylpropyl)-5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridin-2-amine;N-methyl-N-[(5-pyridin-2-yl-1H-pyrazol-4-yl)methyl]propan-1-amine

C81H114N24 — CID 159080531

IUPACN-benzyl-5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridin-2-amine;N,N-diethyl-5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridin-2-amine;5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridine-2-carbonitrile;N-(2-methylpropyl)-5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridin-2-amine;N-methyl-N-[(5-pyridin-2-yl-1H-pyrazol-4-yl)methyl]propan-1-amine
SMILESCCCN(C)Cc1cn[nH]c1-c1ccc(C#N)nc1.CCCN(C)Cc1cn[nH]c1-c1ccc(N(CC)CC)nc1.CCCN(C)Cc1cn[nH]c1-c1ccc(NCC(C)C)nc1.CCCN(C)Cc1cn[nH]c1-c1ccc(NCc2ccccc2)nc1.CCCN(C)Cc1cn[nH]c1-c1ccccn1
InChIInChI=1S/C20H25N5.2C17H27N5.C14H17N5.C13H18N4/c1-3-11-25(2)15-18-14-23-24-20(18)17-9-10-19(22-13-17)21-12-16-7-5-4-6-8-16;1-5-8-22(4)12-15-11-20-21-17(15)14-6-7-16(19-10-14)18-9-13(2)3;1-5-10-21(4)13-15-12-19-20-17(15)14-8-9-16(18-11-14)22(6-2)7-3;1-3-6-19(2)10-12-9-17-18-14(12)11-4-5-13(7-15)16-8-11;1-3-8-17(2)10-11-9-15-16-13(11)12-6-4-5-7-14-12/h4-10,13-14H,3,11-12,15H2,1-2H3,(H,21,22)(H,23,24);6-7,10-11,13H,5,8-9,12H2,1-4H3,(H,18,19)(H,20,21);8-9,11-12H,5-7,10,13H2,1-4H3,(H,19,20);4-5,8-9H,3,6,10H2,1-2H3,(H,17,18);4-7,9H,3,8,10H2,1-2H3,(H,15,16)
InChIKeyKAUJEZYPPXKXFO-UHFFFAOYSA-N
MW1423.97 g/mol
LogP14.97
Rot. Bonds34

About N-benzyl-5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridin-2-amine;N,N-diethyl-5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridin-2-amine;5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridine-2-carbonitrile;N-(2-methylpropyl)-5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridin-2-amine;N-methyl-N-[(5-pyridin-2-yl-1H-pyrazol-4-yl)methyl]propan-1-amine

N-benzyl-5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridin-2-amine;N,N-diethyl-5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridin-2-amine;5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridine-2-carbonitrile;N-(2-methylpropyl)-5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridin-2-amine;N-methyl-N-[(5-pyridin-2-yl-1H-pyrazol-4-yl)methyl]propan-1-amine (PubChem CID 159080531) has the molecular formula C81H114N24 and a molecular weight of 1423.97 g/mol. Its IUPAC name is N-benzyl-5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridin-2-amine;N,N-diethyl-5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridin-2-amine;5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridine-2-carbonitrile;N-(2-methylpropyl)-5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridin-2-amine;N-methyl-N-[(5-pyridin-2-yl-1H-pyrazol-4-yl)methyl]propan-1-amine.

Molecular Properties

Compound NameN-benzyl-5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridin-2-amine;N,N-diethyl-5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridin-2-amine;5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridine-2-carbonitrile;N-(2-methylpropyl)-5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridin-2-amine;N-methyl-N-[(5-pyridin-2-yl-1H-pyrazol-4-yl)methyl]propan-1-amine
PubChem CID159080531
Molecular FormulaC81H114N24
Molecular Weight1423.97 g/mol
Exact Mass1422.97
IUPAC NameN-benzyl-5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridin-2-amine;N,N-diethyl-5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridin-2-amine;5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridine-2-carbonitrile;N-(2-methylpropyl)-5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridin-2-amine;N-methyl-N-[(5-pyridin-2-yl-1H-pyrazol-4-yl)methyl]propan-1-amine
SMILESCCCN(C)Cc1cn[nH]c1-c1ccc(C#N)nc1.CCCN(C)Cc1cn[nH]c1-c1ccc(N(CC)CC)nc1.CCCN(C)Cc1cn[nH]c1-c1ccc(NCC(C)C)nc1.CCCN(C)Cc1cn[nH]c1-c1ccc(NCc2ccccc2)nc1.CCCN(C)Cc1cn[nH]c1-c1ccccn1
InChIInChI=1S/C20H25N5.2C17H27N5.C14H17N5.C13H18N4/c1-3-11-25(2)15-18-14-23-24-20(18)17-9-10-19(22-13-17)21-12-16-7-5-4-6-8-16;1-5-8-22(4)12-15-11-20-21-17(15)14-6-7-16(19-10-14)18-9-13(2)3;1-5-10-21(4)13-15-12-19-20-17(15)14-8-9-16(18-11-14)22(6-2)7-3;1-3-6-19(2)10-12-9-17-18-14(12)11-4-5-13(7-15)16-8-11;1-3-8-17(2)10-11-9-15-16-13(11)12-6-4-5-7-14-12/h4-10,13-14H,3,11-12,15H2,1-2H3,(H,21,22)(H,23,24);6-7,10-11,13H,5,8-9,12H2,1-4H3,(H,18,19)(H,20,21);8-9,11-12H,5-7,10,13H2,1-4H3,(H,19,20);4-5,8-9H,3,6,10H2,1-2H3,(H,17,18);4-7,9H,3,8,10H2,1-2H3,(H,15,16)
InChIKeyKAUJEZYPPXKXFO-UHFFFAOYSA-N
XLogP14.97
TPSA275.14 Ų
H-Bond Donors7
H-Bond Acceptors19
Rotatable Bonds34
Heavy Atoms105
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001423.97
LogP ≤ 514.97
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1019

Analyze N-benzyl-5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridin-2-amine;N,N-diethyl-5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridin-2-amine;5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridine-2-carbonitrile;N-(2-methylpropyl)-5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridin-2-amine;N-methyl-N-[(5-pyridin-2-yl-1H-pyrazol-4-yl)methyl]propan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-Methyl-4-[4-[3-(2-pyridinyl)-1H-pyrazol-4-yl][2,3'-bipyridin]-6'-yl]piperazine
CID 56667031
3-[4-(4-methylpiperazin-1-yl)-1H-pyrrolo[3,2-c]pyridin-2-yl]-5-[5-(piperidin-1-ylmethyl)-3-pyridinyl]-1H-pyrazolo[4,3-b]pyridine
CID 137039424
3-[6-[(1S,4S)-2,5-diazabicyclo[2.2.1]heptan-2-yl]-2-pyridinyl]-5-(1-methylpyrazol-4-yl)-2,3,3a,4,5,6,7,7a-octahydro-1H-pyrazolo[3,4-c]pyridine
CID 123133025
US10023570, Example 171
CID 124199356
US10023570, Example 2
CID 124199695
US10023570, Example 271
CID 124199954
US10023570, Example 483
CID 124200112
US10023570, Example 480
CID 124200128
US10023570, Example 627
CID 124200131
US10023570, Example 542
CID 126740258
US10023570, Example 541
CID 126740315
US10023570, Example 548
CID 126740382

Frequently Asked Questions

What is the IUPAC name of N-benzyl-5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridin-2-amine;N,N-diethyl-5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridin-2-amine;5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridine-2-carbonitrile;N-(2-methylpropyl)-5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridin-2-amine;N-methyl-N-[(5-pyridin-2-yl-1H-pyrazol-4-yl)methyl]propan-1-amine?
The IUPAC name of N-benzyl-5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridin-2-amine;N,N-diethyl-5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridin-2-amine;5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridine-2-carbonitrile;N-(2-methylpropyl)-5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridin-2-amine;N-methyl-N-[(5-pyridin-2-yl-1H-pyrazol-4-yl)methyl]propan-1-amine (CID 159080531) is N-benzyl-5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridin-2-amine;N,N-diethyl-5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridin-2-amine;5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridine-2-carbonitrile;N-(2-methylpropyl)-5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridin-2-amine;N-methyl-N-[(5-pyridin-2-yl-1H-pyrazol-4-yl)methyl]propan-1-amine.
What is the SMILES notation for N-benzyl-5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridin-2-amine;N,N-diethyl-5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridin-2-amine;5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridine-2-carbonitrile;N-(2-methylpropyl)-5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridin-2-amine;N-methyl-N-[(5-pyridin-2-yl-1H-pyrazol-4-yl)methyl]propan-1-amine?
The canonical SMILES for N-benzyl-5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridin-2-amine;N,N-diethyl-5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridin-2-amine;5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridine-2-carbonitrile;N-(2-methylpropyl)-5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridin-2-amine;N-methyl-N-[(5-pyridin-2-yl-1H-pyrazol-4-yl)methyl]propan-1-amine is CCCN(C)Cc1cn[nH]c1-c1ccc(C#N)nc1.CCCN(C)Cc1cn[nH]c1-c1ccc(N(CC)CC)nc1.CCCN(C)Cc1cn[nH]c1-c1ccc(NCC(C)C)nc1.CCCN(C)Cc1cn[nH]c1-c1ccc(NCc2ccccc2)nc1.CCCN(C)Cc1cn[nH]c1-c1ccccn1.
What is the InChIKey of N-benzyl-5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridin-2-amine;N,N-diethyl-5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridin-2-amine;5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridine-2-carbonitrile;N-(2-methylpropyl)-5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridin-2-amine;N-methyl-N-[(5-pyridin-2-yl-1H-pyrazol-4-yl)methyl]propan-1-amine?
The InChIKey is KAUJEZYPPXKXFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N5.2C17H27N5.C14H17N5.C13H18N4/c1-3-11-25(2)15-18-14-23-24-20(18)17-9-10-19(22-13-17)21-12-16-7-5-4-6-8-16;1-5-8-22(4)12-15-11-20-21-17(15)14-6-7-16(19-10-14)18-9-13(2)3;1-5-10-21(4)13-15-12-19-20-17(15)14-8-9-16(18-11-14)22(6-2)7-3;1-3-6-19(2)10-12-9-17-18-14(12)11-4-5-13(7-15)16-8-11;1-3-8-17(2)10-11-9-15-16-13(11)12-6-4-5-7-14-12/h4-10,13-14H,3,11-12,15H2,1-2H3,(H,21,22)(H,23,24);6-7,10-11,13H,5,8-9,12H2,1-4H3,(H,18,19)(H,20,21);8-9,11-12H,5-7,10,13H2,1-4H3,(H,19,20);4-5,8-9H,3,6,10H2,1-2H3,(H,17,18);4-7,9H,3,8,10H2,1-2H3,(H,15,16).
What are the key properties of N-benzyl-5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridin-2-amine;N,N-diethyl-5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridin-2-amine;5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridine-2-carbonitrile;N-(2-methylpropyl)-5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridin-2-amine;N-methyl-N-[(5-pyridin-2-yl-1H-pyrazol-4-yl)methyl]propan-1-amine?
N-benzyl-5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridin-2-amine;N,N-diethyl-5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridin-2-amine;5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridine-2-carbonitrile;N-(2-methylpropyl)-5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridin-2-amine;N-methyl-N-[(5-pyridin-2-yl-1H-pyrazol-4-yl)methyl]propan-1-amine has a molecular weight of 1423.97 g/mol, XLogP of 14.97, 34 rotatable bonds, 7 hydrogen bond donors, and 19 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridin-2-amine;N,N-diethyl-5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridin-2-amine;5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridine-2-carbonitrile;N-(2-methylpropyl)-5-[4-[[methyl(propyl)amino]methyl]-1H-pyrazol-5-yl]pyridin-2-amine;N-methyl-N-[(5-pyridin-2-yl-1H-pyrazol-4-yl)methyl]propan-1-amine is sourced from PubChem (CID 159080531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).