4-amino-N-(2-piperidin-1-ylpropyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide

C15H27N5O — CID 62076238

IUPAC4-amino-N-(2-piperidin-1-ylpropyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide
SMILESCC(C)c1[nH]nc(C(=O)NCC(C)N2CCCCC2)c1N
InChIInChI=1S/C15H27N5O/c1-10(2)13-12(16)14(19-18-13)15(21)17-9-11(3)20-7-5-4-6-8-20/h10-11H,4-9,16H2,1-3H3,(H,17,21)(H,18,19)
InChIKeyNXTIWISRDUCKPB-UHFFFAOYSA-N
MW293.42 g/mol
LogP1.72
Rot. Bonds5

About 4-amino-N-(2-piperidin-1-ylpropyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide

4-amino-N-(2-piperidin-1-ylpropyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide (PubChem CID 62076238) has the molecular formula C15H27N5O and a molecular weight of 293.42 g/mol. Its IUPAC name is 4-amino-N-(2-piperidin-1-ylpropyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide.

Molecular Properties

Compound Name4-amino-N-(2-piperidin-1-ylpropyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide
PubChem CID62076238
Molecular FormulaC15H27N5O
Molecular Weight293.42 g/mol
Exact Mass293.22
IUPAC Name4-amino-N-(2-piperidin-1-ylpropyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide
SMILESCC(C)c1[nH]nc(C(=O)NCC(C)N2CCCCC2)c1N
InChIInChI=1S/C15H27N5O/c1-10(2)13-12(16)14(19-18-13)15(21)17-9-11(3)20-7-5-4-6-8-20/h10-11H,4-9,16H2,1-3H3,(H,17,21)(H,18,19)
InChIKeyNXTIWISRDUCKPB-UHFFFAOYSA-N
XLogP1.72
TPSA87.04 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.42
LogP ≤ 51.72
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-N-(2-hydroxypropyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide
CID 62076723
3,5-dimethyl-N-(2-piperidin-1-ylpropyl)-1H-pyrazole-4-carboxamide
CID 54903954
4-amino-N-(2-methoxy-2-methylpropyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide
CID 104758271
4-amino-N-[2-(4-methylpiperidin-1-yl)ethyl]-5-propan-2-yl-1H-pyrazole-3-carboxamide
CID 62076068
4-amino-1-ethyl-3-methyl-N-(2-piperidin-1-ylpropyl)pyrazole-5-carboxamide
CID 66125626
4-amino-N-morpholin-4-yl-5-propan-2-yl-1H-pyrazole-3-carboxamide
CID 83012582
4-bromo-N-[2-(4-phenylpiperazin-1-yl)propyl]-5-propan-2-yl-1H-pyrazole-3-carboxamide
CID 56564755
4-amino-N-methyl-5-propan-2-yl-N-(2-pyrrolidin-1-ylethyl)-1H-pyrazole-3-carboxamide
CID 63207158
2-pyrrolidin-1-ylpropylurea
CID 112728366
4-amino-N-[2-(2-methoxyethoxy)ethyl]-5-propan-2-yl-1H-pyrazole-3-carboxamide
CID 55033876
(4-amino-5-propan-2-yl-1H-pyrazol-3-yl)-[2-(hydroxymethyl)azepan-1-yl]methanone
CID 116633830
4-amino-1-ethyl-N-(2-piperidin-1-ylpropyl)pyrazole-5-carboxamide
CID 65357655

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(2-piperidin-1-ylpropyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide?
The IUPAC name of 4-amino-N-(2-piperidin-1-ylpropyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide (CID 62076238) is 4-amino-N-(2-piperidin-1-ylpropyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide.
What is the SMILES notation for 4-amino-N-(2-piperidin-1-ylpropyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide?
The canonical SMILES for 4-amino-N-(2-piperidin-1-ylpropyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide is CC(C)c1[nH]nc(C(=O)NCC(C)N2CCCCC2)c1N.
What is the InChIKey of 4-amino-N-(2-piperidin-1-ylpropyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide?
The InChIKey is NXTIWISRDUCKPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N5O/c1-10(2)13-12(16)14(19-18-13)15(21)17-9-11(3)20-7-5-4-6-8-20/h10-11H,4-9,16H2,1-3H3,(H,17,21)(H,18,19).
What are the key properties of 4-amino-N-(2-piperidin-1-ylpropyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide?
4-amino-N-(2-piperidin-1-ylpropyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide has a molecular weight of 293.42 g/mol, XLogP of 1.72, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(2-piperidin-1-ylpropyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide is sourced from PubChem (CID 62076238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).