N-[(1-methylpyrazol-4-yl)methyl]-N-propylpiperidin-4-amine

C13H24N4 — CID 60806152

IUPACN-[(1-methylpyrazol-4-yl)methyl]-N-propylpiperidin-4-amine
SMILESCCCN(Cc1cnn(C)c1)C1CCNCC1
InChIInChI=1S/C13H24N4/c1-3-8-17(13-4-6-14-7-5-13)11-12-9-15-16(2)10-12/h9-10,13-14H,3-8,11H2,1-2H3
InChIKeyRVMDJZVKIJSTHG-UHFFFAOYSA-N
MW236.36 g/mol
LogP1.38
Rot. Bonds5

About N-[(1-methylpyrazol-4-yl)methyl]-N-propylpiperidin-4-amine

N-[(1-methylpyrazol-4-yl)methyl]-N-propylpiperidin-4-amine (PubChem CID 60806152) has the molecular formula C13H24N4 and a molecular weight of 236.36 g/mol. Its IUPAC name is N-[(1-methylpyrazol-4-yl)methyl]-N-propylpiperidin-4-amine.

Molecular Properties

Compound NameN-[(1-methylpyrazol-4-yl)methyl]-N-propylpiperidin-4-amine
PubChem CID60806152
Molecular FormulaC13H24N4
Molecular Weight236.36 g/mol
Exact Mass236.20
IUPAC NameN-[(1-methylpyrazol-4-yl)methyl]-N-propylpiperidin-4-amine
SMILESCCCN(Cc1cnn(C)c1)C1CCNCC1
InChIInChI=1S/C13H24N4/c1-3-8-17(13-4-6-14-7-5-13)11-12-9-15-16(2)10-12/h9-10,13-14H,3-8,11H2,1-2H3
InChIKeyRVMDJZVKIJSTHG-UHFFFAOYSA-N
XLogP1.38
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(1-methylpyrazol-4-yl)methyl]-N-propylpiperidin-3-amine
CID 63636731
2-(1-methylpyrazol-4-yl)-N-piperidin-4-yl-N-propylacetamide
CID 119823248
N'-cyclobutyl-N'-[(1-methylpyrazol-4-yl)methyl]ethane-1,2-diamine
CID 102875260
N-[(3,4-dichlorophenyl)methyl]-N-propylpiperidin-4-amine
CID 60806819
N'-cyclohexyl-N'-[(1-methylpyrazol-4-yl)methyl]propane-1,3-diamine
CID 62127404
N-[2-(4-chloropyrazol-1-yl)ethyl]-N-[(1-methylpyrazol-4-yl)methyl]cyclopropanamine
CID 91829151
3-(1-methylpyrazol-4-yl)-N-propyl-N-pyrrolidin-3-ylpropanamide;dihydrochloride
CID 119532209
N-[(2-ethyl-1,2,4-triazol-3-yl)methyl]-N-[(1-methylpyrazol-4-yl)methyl]cyclopropanamine
CID 77093844
3-[cyclopropyl-[(1-methylpyrazol-4-yl)methyl]amino]-N'-hydroxypropanimidamide
CID 76936306
N-propyl-N-(2-pyrazol-1-ylethyl)piperidin-4-amine
CID 54960820
N-[(5-bromo-2-pyridinyl)methyl]-N-propylpiperidin-4-amine
CID 115741636
4-[[piperidin-4-yl(propyl)amino]methyl]pyridine-2-carbonitrile
CID 63880798

Frequently Asked Questions

What is the IUPAC name of N-[(1-methylpyrazol-4-yl)methyl]-N-propylpiperidin-4-amine?
The IUPAC name of N-[(1-methylpyrazol-4-yl)methyl]-N-propylpiperidin-4-amine (CID 60806152) is N-[(1-methylpyrazol-4-yl)methyl]-N-propylpiperidin-4-amine.
What is the SMILES notation for N-[(1-methylpyrazol-4-yl)methyl]-N-propylpiperidin-4-amine?
The canonical SMILES for N-[(1-methylpyrazol-4-yl)methyl]-N-propylpiperidin-4-amine is CCCN(Cc1cnn(C)c1)C1CCNCC1.
What is the InChIKey of N-[(1-methylpyrazol-4-yl)methyl]-N-propylpiperidin-4-amine?
The InChIKey is RVMDJZVKIJSTHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N4/c1-3-8-17(13-4-6-14-7-5-13)11-12-9-15-16(2)10-12/h9-10,13-14H,3-8,11H2,1-2H3.
What are the key properties of N-[(1-methylpyrazol-4-yl)methyl]-N-propylpiperidin-4-amine?
N-[(1-methylpyrazol-4-yl)methyl]-N-propylpiperidin-4-amine has a molecular weight of 236.36 g/mol, XLogP of 1.38, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-methylpyrazol-4-yl)methyl]-N-propylpiperidin-4-amine is sourced from PubChem (CID 60806152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).