4-amino-5-propyl-N-(1-pyridin-4-ylethyl)-1H-pyrazole-3-carboxamide

C14H19N5O — CID 62076755

IUPAC4-amino-5-propyl-N-(1-pyridin-4-ylethyl)-1H-pyrazole-3-carboxamide
SMILESCCCc1[nH]nc(C(=O)NC(C)c2ccncc2)c1N
InChIInChI=1S/C14H19N5O/c1-3-4-11-12(15)13(19-18-11)14(20)17-9(2)10-5-7-16-8-6-10/h5-9H,3-4,15H2,1-2H3,(H,17,20)(H,18,19)
InChIKeyLWLLKMRSALXWSO-UHFFFAOYSA-N
MW273.34 g/mol
LogP1.83
Rot. Bonds5

About 4-amino-5-propyl-N-(1-pyridin-4-ylethyl)-1H-pyrazole-3-carboxamide

4-amino-5-propyl-N-(1-pyridin-4-ylethyl)-1H-pyrazole-3-carboxamide (PubChem CID 62076755) has the molecular formula C14H19N5O and a molecular weight of 273.34 g/mol. Its IUPAC name is 4-amino-5-propyl-N-(1-pyridin-4-ylethyl)-1H-pyrazole-3-carboxamide.

Molecular Properties

Compound Name4-amino-5-propyl-N-(1-pyridin-4-ylethyl)-1H-pyrazole-3-carboxamide
PubChem CID62076755
Molecular FormulaC14H19N5O
Molecular Weight273.34 g/mol
Exact Mass273.16
IUPAC Name4-amino-5-propyl-N-(1-pyridin-4-ylethyl)-1H-pyrazole-3-carboxamide
SMILESCCCc1[nH]nc(C(=O)NC(C)c2ccncc2)c1N
InChIInChI=1S/C14H19N5O/c1-3-4-11-12(15)13(19-18-11)14(20)17-9(2)10-5-7-16-8-6-10/h5-9H,3-4,15H2,1-2H3,(H,17,20)(H,18,19)
InChIKeyLWLLKMRSALXWSO-UHFFFAOYSA-N
XLogP1.83
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 ≤ 51.83
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-5-propyl-N-[1-(1H-pyrazol-4-yl)ethyl]-1H-pyrazole-3-carboxamide
CID 106208024
4-amino-5-ethyl-N-[1-(4-methylphenyl)ethyl]-1H-pyrazole-3-carboxamide
CID 62080944
4-amino-N-(5-methylhexan-2-yl)-5-propyl-1H-pyrazole-3-carboxamide
CID 55034501
4-amino-N-(3,3-dimethylbutan-2-yl)-5-propyl-1H-pyrazole-3-carboxamide
CID 113457627
4-amino-N-tert-butyl-5-propyl-1H-pyrazole-3-carboxamide
CID 62075103
4-amino-5-ethyl-N-(1-thiophen-3-ylethyl)-1H-pyrazole-3-carboxamide
CID 62841807
4-amino-N-[(3-methyl-4-pyridinyl)methyl]-5-propyl-1H-pyrazole-3-carboxamide
CID 114698169
4-amino-N-[1-(dimethylamino)-4-methylpentan-2-yl]-5-propyl-1H-pyrazole-3-carboxamide
CID 62077091
4-amino-N-(2,2-difluoroethyl)-5-propyl-1H-pyrazole-3-carboxamide
CID 115405291
4-amino-N-[(4-ethylphenyl)methyl]-5-propyl-1H-pyrazole-3-carboxamide
CID 106899103
4-amino-5-ethyl-N-[1-(furan-2-yl)ethyl]-1H-pyrazole-3-carboxamide
CID 62082159
4-amino-N-ethyl-5-propyl-N-(pyridin-4-ylmethyl)-1H-pyrazole-3-carboxamide
CID 62076293

Frequently Asked Questions

What is the IUPAC name of 4-amino-5-propyl-N-(1-pyridin-4-ylethyl)-1H-pyrazole-3-carboxamide?
The IUPAC name of 4-amino-5-propyl-N-(1-pyridin-4-ylethyl)-1H-pyrazole-3-carboxamide (CID 62076755) is 4-amino-5-propyl-N-(1-pyridin-4-ylethyl)-1H-pyrazole-3-carboxamide.
What is the SMILES notation for 4-amino-5-propyl-N-(1-pyridin-4-ylethyl)-1H-pyrazole-3-carboxamide?
The canonical SMILES for 4-amino-5-propyl-N-(1-pyridin-4-ylethyl)-1H-pyrazole-3-carboxamide is CCCc1[nH]nc(C(=O)NC(C)c2ccncc2)c1N.
What is the InChIKey of 4-amino-5-propyl-N-(1-pyridin-4-ylethyl)-1H-pyrazole-3-carboxamide?
The InChIKey is LWLLKMRSALXWSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N5O/c1-3-4-11-12(15)13(19-18-11)14(20)17-9(2)10-5-7-16-8-6-10/h5-9H,3-4,15H2,1-2H3,(H,17,20)(H,18,19).
What are the key properties of 4-amino-5-propyl-N-(1-pyridin-4-ylethyl)-1H-pyrazole-3-carboxamide?
4-amino-5-propyl-N-(1-pyridin-4-ylethyl)-1H-pyrazole-3-carboxamide has a molecular weight of 273.34 g/mol, XLogP of 1.83, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-5-propyl-N-(1-pyridin-4-ylethyl)-1H-pyrazole-3-carboxamide is sourced from PubChem (CID 62076755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).