4-amino-N-ethyl-5-propan-2-yl-N-pyridin-4-yl-1H-pyrazole-3-carboxamide

C14H19N5O — CID 106934373

IUPAC4-amino-N-ethyl-5-propan-2-yl-N-pyridin-4-yl-1H-pyrazole-3-carboxamide
SMILESCCN(C(=O)c1n[nH]c(C(C)C)c1N)c1ccncc1
InChIInChI=1S/C14H19N5O/c1-4-19(10-5-7-16-8-6-10)14(20)13-11(15)12(9(2)3)17-18-13/h5-9H,4,15H2,1-3H3,(H,17,18)
InChIKeyIVQCAPSIELXTSH-UHFFFAOYSA-N
MW273.34 g/mol
LogP2.18
Rot. Bonds4

About 4-amino-N-ethyl-5-propan-2-yl-N-pyridin-4-yl-1H-pyrazole-3-carboxamide

4-amino-N-ethyl-5-propan-2-yl-N-pyridin-4-yl-1H-pyrazole-3-carboxamide (PubChem CID 106934373) has the molecular formula C14H19N5O and a molecular weight of 273.34 g/mol. Its IUPAC name is 4-amino-N-ethyl-5-propan-2-yl-N-pyridin-4-yl-1H-pyrazole-3-carboxamide.

Molecular Properties

Compound Name4-amino-N-ethyl-5-propan-2-yl-N-pyridin-4-yl-1H-pyrazole-3-carboxamide
PubChem CID106934373
Molecular FormulaC14H19N5O
Molecular Weight273.34 g/mol
Exact Mass273.16
IUPAC Name4-amino-N-ethyl-5-propan-2-yl-N-pyridin-4-yl-1H-pyrazole-3-carboxamide
SMILESCCN(C(=O)c1n[nH]c(C(C)C)c1N)c1ccncc1
InChIInChI=1S/C14H19N5O/c1-4-19(10-5-7-16-8-6-10)14(20)13-11(15)12(9(2)3)17-18-13/h5-9H,4,15H2,1-3H3,(H,17,18)
InChIKeyIVQCAPSIELXTSH-UHFFFAOYSA-N
XLogP2.18
TPSA87.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 52.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-N,5-diethyl-N-pyridin-4-yl-1H-pyrazole-3-carboxamide
CID 106934374
(2R)-2-amino-N-ethyl-N-pyridin-4-ylpropanamide
CID 106935605
4-amino-5-cyclopropyl-N-ethyl-N-phenyl-1H-pyrazole-3-carboxamide
CID 62077121
4-amino-N-(2-ethoxyethyl)-N-ethyl-5-propan-2-yl-1H-pyrazole-3-carboxamide
CID 55227290
4-amino-5-propan-2-yl-N,N-bis(prop-2-enyl)-1H-pyrazole-3-carboxamide
CID 62076228
4-amino-N,5-di(propan-2-yl)-N-(thiophen-2-ylmethyl)-1H-pyrazole-3-carboxamide
CID 62077582
4-amino-N-[(4-bromophenyl)methyl]-N-methyl-5-propan-2-yl-1H-pyrazole-3-carboxamide
CID 62076563
propan-2-yl N-ethyl-N-pyridin-4-ylcarbamate
CID 106934812
4-amino-N-ethyl-5-propyl-N-(pyridin-4-ylmethyl)-1H-pyrazole-3-carboxamide
CID 62076293
2-amino-N-ethyl-6-methyl-N-pyridin-4-ylbenzamide
CID 106934342
4-amino-N-(2-hydroxypropyl)-5-propan-2-yl-1H-pyrazole-3-carboxamide
CID 62076723
4-amino-5-propan-2-yl-N-(2-pyrazol-1-ylethyl)-1H-pyrazole-3-carboxamide
CID 62077584

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-ethyl-5-propan-2-yl-N-pyridin-4-yl-1H-pyrazole-3-carboxamide?
The IUPAC name of 4-amino-N-ethyl-5-propan-2-yl-N-pyridin-4-yl-1H-pyrazole-3-carboxamide (CID 106934373) is 4-amino-N-ethyl-5-propan-2-yl-N-pyridin-4-yl-1H-pyrazole-3-carboxamide.
What is the SMILES notation for 4-amino-N-ethyl-5-propan-2-yl-N-pyridin-4-yl-1H-pyrazole-3-carboxamide?
The canonical SMILES for 4-amino-N-ethyl-5-propan-2-yl-N-pyridin-4-yl-1H-pyrazole-3-carboxamide is CCN(C(=O)c1n[nH]c(C(C)C)c1N)c1ccncc1.
What is the InChIKey of 4-amino-N-ethyl-5-propan-2-yl-N-pyridin-4-yl-1H-pyrazole-3-carboxamide?
The InChIKey is IVQCAPSIELXTSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N5O/c1-4-19(10-5-7-16-8-6-10)14(20)13-11(15)12(9(2)3)17-18-13/h5-9H,4,15H2,1-3H3,(H,17,18).
What are the key properties of 4-amino-N-ethyl-5-propan-2-yl-N-pyridin-4-yl-1H-pyrazole-3-carboxamide?
4-amino-N-ethyl-5-propan-2-yl-N-pyridin-4-yl-1H-pyrazole-3-carboxamide has a molecular weight of 273.34 g/mol, XLogP of 2.18, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-ethyl-5-propan-2-yl-N-pyridin-4-yl-1H-pyrazole-3-carboxamide is sourced from PubChem (CID 106934373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).