4-amino-N-[(3-methyl-4-pyridinyl)methyl]-5-propyl-1H-pyrazole-3-carboxamide

C14H19N5O — CID 114698169

IUPAC4-amino-N-[(3-methyl-4-pyridinyl)methyl]-5-propyl-1H-pyrazole-3-carboxamide
SMILESCCCc1[nH]nc(C(=O)NCc2ccncc2C)c1N
InChIInChI=1S/C14H19N5O/c1-3-4-11-12(15)13(19-18-11)14(20)17-8-10-5-6-16-7-9(10)2/h5-7H,3-4,8,15H2,1-2H3,(H,17,20)(H,18,19)
InChIKeyZTGUKOXHLITFFB-UHFFFAOYSA-N
MW273.34 g/mol
LogP1.58
Rot. Bonds5

About 4-amino-N-[(3-methyl-4-pyridinyl)methyl]-5-propyl-1H-pyrazole-3-carboxamide

4-amino-N-[(3-methyl-4-pyridinyl)methyl]-5-propyl-1H-pyrazole-3-carboxamide (PubChem CID 114698169) has the molecular formula C14H19N5O and a molecular weight of 273.34 g/mol. Its IUPAC name is 4-amino-N-[(3-methyl-4-pyridinyl)methyl]-5-propyl-1H-pyrazole-3-carboxamide.

Molecular Properties

Compound Name4-amino-N-[(3-methyl-4-pyridinyl)methyl]-5-propyl-1H-pyrazole-3-carboxamide
PubChem CID114698169
Molecular FormulaC14H19N5O
Molecular Weight273.34 g/mol
Exact Mass273.16
IUPAC Name4-amino-N-[(3-methyl-4-pyridinyl)methyl]-5-propyl-1H-pyrazole-3-carboxamide
SMILESCCCc1[nH]nc(C(=O)NCc2ccncc2C)c1N
InChIInChI=1S/C14H19N5O/c1-3-4-11-12(15)13(19-18-11)14(20)17-8-10-5-6-16-7-9(10)2/h5-7H,3-4,8,15H2,1-2H3,(H,17,20)(H,18,19)
InChIKeyZTGUKOXHLITFFB-UHFFFAOYSA-N
XLogP1.58
TPSA96.69 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 51.58
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-N-[(4-ethylphenyl)methyl]-5-propyl-1H-pyrazole-3-carboxamide
CID 106899103
4-amino-N-[(4,5-dimethylthiophen-2-yl)methyl]-5-propyl-1H-pyrazole-3-carboxamide
CID 65241562
4-amino-N-[(3-methylphenyl)methyl]-5-propyl-1H-pyrazole-3-carboxamide
CID 62077427
4-amino-N-[(5-methyl-1,3-oxazol-2-yl)methyl]-5-propyl-1H-pyrazole-3-carboxamide
CID 106368577
4-amino-5-ethyl-N-(3-methyl-4-pyridinyl)-1H-pyrazole-3-carboxamide
CID 63669329
4-amino-5-propyl-N-(1-pyridin-4-ylethyl)-1H-pyrazole-3-carboxamide
CID 62076755
4-amino-N-[(3-ethyl-1-methylpyrazol-4-yl)methyl]-5-propyl-1H-pyrazole-3-carboxamide
CID 115988894
4-amino-N-[(3,4-difluorophenyl)methyl]-5-propyl-1H-pyrazole-3-carboxamide
CID 62076796
3,5-diamino-N-[(3-methyl-4-pyridinyl)methyl]benzamide
CID 114698194
N-[(3-methyl-4-pyridinyl)methyl]-3-(propylamino)pyridine-4-carboxamide
CID 105071463
N-[(3-methyl-4-pyridinyl)methyl]-5-propan-2-yl-1H-1,2,4-triazole-3-carboxamide
CID 114701643
2-chloro-N-[(3-methyl-4-pyridinyl)methyl]-6-propylpyridine-4-carboxamide
CID 114699468

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-[(3-methyl-4-pyridinyl)methyl]-5-propyl-1H-pyrazole-3-carboxamide?
The IUPAC name of 4-amino-N-[(3-methyl-4-pyridinyl)methyl]-5-propyl-1H-pyrazole-3-carboxamide (CID 114698169) is 4-amino-N-[(3-methyl-4-pyridinyl)methyl]-5-propyl-1H-pyrazole-3-carboxamide.
What is the SMILES notation for 4-amino-N-[(3-methyl-4-pyridinyl)methyl]-5-propyl-1H-pyrazole-3-carboxamide?
The canonical SMILES for 4-amino-N-[(3-methyl-4-pyridinyl)methyl]-5-propyl-1H-pyrazole-3-carboxamide is CCCc1[nH]nc(C(=O)NCc2ccncc2C)c1N.
What is the InChIKey of 4-amino-N-[(3-methyl-4-pyridinyl)methyl]-5-propyl-1H-pyrazole-3-carboxamide?
The InChIKey is ZTGUKOXHLITFFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N5O/c1-3-4-11-12(15)13(19-18-11)14(20)17-8-10-5-6-16-7-9(10)2/h5-7H,3-4,8,15H2,1-2H3,(H,17,20)(H,18,19).
What are the key properties of 4-amino-N-[(3-methyl-4-pyridinyl)methyl]-5-propyl-1H-pyrazole-3-carboxamide?
4-amino-N-[(3-methyl-4-pyridinyl)methyl]-5-propyl-1H-pyrazole-3-carboxamide has a molecular weight of 273.34 g/mol, XLogP of 1.58, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-[(3-methyl-4-pyridinyl)methyl]-5-propyl-1H-pyrazole-3-carboxamide is sourced from PubChem (CID 114698169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).