N-[3-[(2-cyclopentylpyrazol-3-yl)amino]-3-oxopropyl]cyclopentanecarboxamide

C17H26N4O2 — CID 71942007

IUPACN-[3-[(2-cyclopentylpyrazol-3-yl)amino]-3-oxopropyl]cyclopentanecarboxamide
SMILESO=C(CCNC(=O)C1CCCC1)Nc1ccnn1C1CCCC1
InChIInChI=1S/C17H26N4O2/c22-16(10-11-18-17(23)13-5-1-2-6-13)20-15-9-12-19-21(15)14-7-3-4-8-14/h9,12-14H,1-8,10-11H2,(H,18,23)(H,20,22)
InChIKeyYJIUZIFSZRWYRW-UHFFFAOYSA-N
MW318.42 g/mol
LogP2.63
Rot. Bonds6

About N-[3-[(2-cyclopentylpyrazol-3-yl)amino]-3-oxopropyl]cyclopentanecarboxamide

N-[3-[(2-cyclopentylpyrazol-3-yl)amino]-3-oxopropyl]cyclopentanecarboxamide (PubChem CID 71942007) has the molecular formula C17H26N4O2 and a molecular weight of 318.42 g/mol. Its IUPAC name is N-[3-[(2-cyclopentylpyrazol-3-yl)amino]-3-oxopropyl]cyclopentanecarboxamide.

Molecular Properties

Compound NameN-[3-[(2-cyclopentylpyrazol-3-yl)amino]-3-oxopropyl]cyclopentanecarboxamide
PubChem CID71942007
Molecular FormulaC17H26N4O2
Molecular Weight318.42 g/mol
Exact Mass318.21
IUPAC NameN-[3-[(2-cyclopentylpyrazol-3-yl)amino]-3-oxopropyl]cyclopentanecarboxamide
SMILESO=C(CCNC(=O)C1CCCC1)Nc1ccnn1C1CCCC1
InChIInChI=1S/C17H26N4O2/c22-16(10-11-18-17(23)13-5-1-2-6-13)20-15-9-12-19-21(15)14-7-3-4-8-14/h9,12-14H,1-8,10-11H2,(H,18,23)(H,20,22)
InChIKeyYJIUZIFSZRWYRW-UHFFFAOYSA-N
XLogP2.63
TPSA76.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.42
LogP ≤ 52.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2,4-dimethylpentan-3-yl N-[(3S)-1-[(2-cyclopentylpyrazol-3-yl)amino]-1,2-dioxoheptan-3-yl]carbamate
CID 11305090
N-{1-[1-(2,6-dimethyl-5-hepten-1-yl)-4-piperidinyl]-1H-pyrazol-5-yl}cyclopentanecarboxamide
CID 24818932
N-{1-[1-(3-hydroxy-2,2-dimethylpropyl)-4-piperidinyl]-1H-pyrazol-5-yl}cyclopentanecarboxamide
CID 24816873
N-(1-{1-[(1-ethyl-1H-pyrazol-4-yl)methyl]-4-piperidinyl}-1H-pyrazol-5-yl)cyclopentanecarboxamide
CID 24819485
N-(1-{1-[(1-methyl-1H-pyrazol-4-yl)methyl]-4-piperidinyl}-1H-pyrazol-5-yl)cyclopentanecarboxamide
CID 24790288
N-(1-{1-[(1-isopropyl-1H-pyrazol-4-yl)methyl]-4-piperidinyl}-1H-pyrazol-5-yl)cyclopentanecarboxamide
CID 24794235
N-(2-cyclopentylpyrazol-3-yl)-3-(1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)propanamide
CID 42906833
N-(1-{1-[2-(1H-pyrazol-1-yl)acetyl]-4-piperidinyl}-1H-pyrazol-5-yl)cyclopentanecarboxamide
CID 25381393
N-(1-{1-[3-(1H-pyrazol-1-yl)propyl]-4-piperidinyl}-1H-pyrazol-5-yl)cyclopentanecarboxamide
CID 26405004
N-(1-cyclohexyl-1H-pyrazol-5-yl)-2-cyclopropylacetamide
CID 29022543
N-(1-ethyl-1H-pyrazol-3-yl)cyclopentanecarboxamide
CID 35525134
ethyl 4-{5-[(cyclopentylcarbonyl)amino]-1H-pyrazol-1-yl}-1,4'-bipiperidine-1'-carboxylate
CID 42213840

Frequently Asked Questions

What is the IUPAC name of N-[3-[(2-cyclopentylpyrazol-3-yl)amino]-3-oxopropyl]cyclopentanecarboxamide?
The IUPAC name of N-[3-[(2-cyclopentylpyrazol-3-yl)amino]-3-oxopropyl]cyclopentanecarboxamide (CID 71942007) is N-[3-[(2-cyclopentylpyrazol-3-yl)amino]-3-oxopropyl]cyclopentanecarboxamide.
What is the SMILES notation for N-[3-[(2-cyclopentylpyrazol-3-yl)amino]-3-oxopropyl]cyclopentanecarboxamide?
The canonical SMILES for N-[3-[(2-cyclopentylpyrazol-3-yl)amino]-3-oxopropyl]cyclopentanecarboxamide is O=C(CCNC(=O)C1CCCC1)Nc1ccnn1C1CCCC1.
What is the InChIKey of N-[3-[(2-cyclopentylpyrazol-3-yl)amino]-3-oxopropyl]cyclopentanecarboxamide?
The InChIKey is YJIUZIFSZRWYRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N4O2/c22-16(10-11-18-17(23)13-5-1-2-6-13)20-15-9-12-19-21(15)14-7-3-4-8-14/h9,12-14H,1-8,10-11H2,(H,18,23)(H,20,22).
What are the key properties of N-[3-[(2-cyclopentylpyrazol-3-yl)amino]-3-oxopropyl]cyclopentanecarboxamide?
N-[3-[(2-cyclopentylpyrazol-3-yl)amino]-3-oxopropyl]cyclopentanecarboxamide has a molecular weight of 318.42 g/mol, XLogP of 2.63, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[(2-cyclopentylpyrazol-3-yl)amino]-3-oxopropyl]cyclopentanecarboxamide is sourced from PubChem (CID 71942007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).