4-(5-cyclopropyl-1H-pyrazol-3-yl)-N-(1-pyridin-3-ylethyl)piperazine-1-carboxamide

C18H24N6O — CID 126793673

IUPAC4-(5-cyclopropyl-1H-pyrazol-3-yl)-N-(1-pyridin-3-ylethyl)piperazine-1-carboxamide
SMILESCC(NC(=O)N1CCN(c2cc(C3CC3)[nH]n2)CC1)c1cccnc1
InChIInChI=1S/C18H24N6O/c1-13(15-3-2-6-19-12-15)20-18(25)24-9-7-23(8-10-24)17-11-16(21-22-17)14-4-5-14/h2-3,6,11-14H,4-5,7-10H2,1H3,(H,20,25)(H,21,22)
InChIKeyKFHZRBJHMINCSF-UHFFFAOYSA-N
MW340.43 g/mol
LogP2.27
Rot. Bonds4

About 4-(5-cyclopropyl-1H-pyrazol-3-yl)-N-(1-pyridin-3-ylethyl)piperazine-1-carboxamide

4-(5-cyclopropyl-1H-pyrazol-3-yl)-N-(1-pyridin-3-ylethyl)piperazine-1-carboxamide (PubChem CID 126793673) has the molecular formula C18H24N6O and a molecular weight of 340.43 g/mol. Its IUPAC name is 4-(5-cyclopropyl-1H-pyrazol-3-yl)-N-(1-pyridin-3-ylethyl)piperazine-1-carboxamide.

Molecular Properties

Compound Name4-(5-cyclopropyl-1H-pyrazol-3-yl)-N-(1-pyridin-3-ylethyl)piperazine-1-carboxamide
PubChem CID126793673
Molecular FormulaC18H24N6O
Molecular Weight340.43 g/mol
Exact Mass340.20
IUPAC Name4-(5-cyclopropyl-1H-pyrazol-3-yl)-N-(1-pyridin-3-ylethyl)piperazine-1-carboxamide
SMILESCC(NC(=O)N1CCN(c2cc(C3CC3)[nH]n2)CC1)c1cccnc1
InChIInChI=1S/C18H24N6O/c1-13(15-3-2-6-19-12-15)20-18(25)24-9-7-23(8-10-24)17-11-16(21-22-17)14-4-5-14/h2-3,6,11-14H,4-5,7-10H2,1H3,(H,20,25)(H,21,22)
InChIKeyKFHZRBJHMINCSF-UHFFFAOYSA-N
XLogP2.27
TPSA77.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 52.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1-pyridin-3-ylethyl)morpholine-4-carboxamide
CID 115576612
4-[(1S,2R,4S)-2-bicyclo[2.2.1]heptanyl]-N-[(1R)-1-pyridin-3-ylethyl]piperazine-1-carboxamide
CID 98873092
4-[(1S,2S,4S)-2-bicyclo[2.2.1]heptanyl]-N-[(1S)-1-pyridin-3-ylethyl]piperazine-1-carboxamide
CID 124778179
N-(2-propan-2-ylcyclohexyl)-4-(1-pyridin-3-ylethyl)piperazine-1-carboxamide
CID 86953620
N-(1-phenylethyl)-4-pyridin-2-ylpiperazine-1-carboxamide
CID 108988786
4-amino-5-cyclopropyl-N-(1-pyridin-3-ylethyl)-1H-pyrazole-3-carboxamide
CID 62075948
2-[4-(5-cyclopropyl-1H-pyrazol-3-yl)piperazin-1-yl]-N-[1-(2-methoxyphenyl)ethyl]acetamide
CID 126789735
(2R)-N-(5-cyclopentyl-1H-pyrazol-3-yl)-2-pyridin-3-ylpropanamide
CID 164630164
(3R)-3-(4-methyl-1,2,4-triazol-3-yl)-N-[(1S)-1-pyridin-3-ylethyl]piperidine-1-carboxamide
CID 97089224
3-[(4-methylpiperidin-1-yl)methyl]-N-(1-pyridin-3-ylethyl)piperidine-1-carboxamide
CID 56825492
N-[(1S)-2-methyl-1-pyridin-3-ylpropyl]azocane-1-carboxamide
CID 125442514
1-[4-[[(1S)-1-pyridin-3-ylethyl]amino]piperidin-1-yl]ethanone
CID 78950814

Frequently Asked Questions

What is the IUPAC name of 4-(5-cyclopropyl-1H-pyrazol-3-yl)-N-(1-pyridin-3-ylethyl)piperazine-1-carboxamide?
The IUPAC name of 4-(5-cyclopropyl-1H-pyrazol-3-yl)-N-(1-pyridin-3-ylethyl)piperazine-1-carboxamide (CID 126793673) is 4-(5-cyclopropyl-1H-pyrazol-3-yl)-N-(1-pyridin-3-ylethyl)piperazine-1-carboxamide.
What is the SMILES notation for 4-(5-cyclopropyl-1H-pyrazol-3-yl)-N-(1-pyridin-3-ylethyl)piperazine-1-carboxamide?
The canonical SMILES for 4-(5-cyclopropyl-1H-pyrazol-3-yl)-N-(1-pyridin-3-ylethyl)piperazine-1-carboxamide is CC(NC(=O)N1CCN(c2cc(C3CC3)[nH]n2)CC1)c1cccnc1.
What is the InChIKey of 4-(5-cyclopropyl-1H-pyrazol-3-yl)-N-(1-pyridin-3-ylethyl)piperazine-1-carboxamide?
The InChIKey is KFHZRBJHMINCSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N6O/c1-13(15-3-2-6-19-12-15)20-18(25)24-9-7-23(8-10-24)17-11-16(21-22-17)14-4-5-14/h2-3,6,11-14H,4-5,7-10H2,1H3,(H,20,25)(H,21,22).
What are the key properties of 4-(5-cyclopropyl-1H-pyrazol-3-yl)-N-(1-pyridin-3-ylethyl)piperazine-1-carboxamide?
4-(5-cyclopropyl-1H-pyrazol-3-yl)-N-(1-pyridin-3-ylethyl)piperazine-1-carboxamide has a molecular weight of 340.43 g/mol, XLogP of 2.27, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-cyclopropyl-1H-pyrazol-3-yl)-N-(1-pyridin-3-ylethyl)piperazine-1-carboxamide is sourced from PubChem (CID 126793673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).