N-[3-[(2,5-dimethylpyrazol-3-yl)amino]-3-oxopropyl]cyclopentanecarboxamide

C14H22N4O2 — CID 38022798

IUPACN-[3-[(2,5-dimethylpyrazol-3-yl)amino]-3-oxopropyl]cyclopentanecarboxamide
SMILESCc1cc(NC(=O)CCNC(=O)C2CCCC2)n(C)n1
InChIInChI=1S/C14H22N4O2/c1-10-9-12(18(2)17-10)16-13(19)7-8-15-14(20)11-5-3-4-6-11/h9,11H,3-8H2,1-2H3,(H,15,20)(H,16,19)
InChIKeyHYNCRIXZPRIMBU-UHFFFAOYSA-N
MW278.36 g/mol
LogP1.36
Rot. Bonds5

About N-[3-[(2,5-dimethylpyrazol-3-yl)amino]-3-oxopropyl]cyclopentanecarboxamide

N-[3-[(2,5-dimethylpyrazol-3-yl)amino]-3-oxopropyl]cyclopentanecarboxamide (PubChem CID 38022798) has the molecular formula C14H22N4O2 and a molecular weight of 278.36 g/mol. Its IUPAC name is N-[3-[(2,5-dimethylpyrazol-3-yl)amino]-3-oxopropyl]cyclopentanecarboxamide.

Molecular Properties

Compound NameN-[3-[(2,5-dimethylpyrazol-3-yl)amino]-3-oxopropyl]cyclopentanecarboxamide
PubChem CID38022798
Molecular FormulaC14H22N4O2
Molecular Weight278.36 g/mol
Exact Mass278.17
IUPAC NameN-[3-[(2,5-dimethylpyrazol-3-yl)amino]-3-oxopropyl]cyclopentanecarboxamide
SMILESCc1cc(NC(=O)CCNC(=O)C2CCCC2)n(C)n1
InChIInChI=1S/C14H22N4O2/c1-10-9-12(18(2)17-10)16-13(19)7-8-15-14(20)11-5-3-4-6-11/h9,11H,3-8H2,1-2H3,(H,15,20)(H,16,19)
InChIKeyHYNCRIXZPRIMBU-UHFFFAOYSA-N
XLogP1.36
TPSA76.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 51.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[3-[(2,5-dimethylpyrazol-3-yl)amino]-3-oxopropyl]cyclopentanecarboxamide?
The IUPAC name of N-[3-[(2,5-dimethylpyrazol-3-yl)amino]-3-oxopropyl]cyclopentanecarboxamide (CID 38022798) is N-[3-[(2,5-dimethylpyrazol-3-yl)amino]-3-oxopropyl]cyclopentanecarboxamide.
What is the SMILES notation for N-[3-[(2,5-dimethylpyrazol-3-yl)amino]-3-oxopropyl]cyclopentanecarboxamide?
The canonical SMILES for N-[3-[(2,5-dimethylpyrazol-3-yl)amino]-3-oxopropyl]cyclopentanecarboxamide is Cc1cc(NC(=O)CCNC(=O)C2CCCC2)n(C)n1.
What is the InChIKey of N-[3-[(2,5-dimethylpyrazol-3-yl)amino]-3-oxopropyl]cyclopentanecarboxamide?
The InChIKey is HYNCRIXZPRIMBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O2/c1-10-9-12(18(2)17-10)16-13(19)7-8-15-14(20)11-5-3-4-6-11/h9,11H,3-8H2,1-2H3,(H,15,20)(H,16,19).
What are the key properties of N-[3-[(2,5-dimethylpyrazol-3-yl)amino]-3-oxopropyl]cyclopentanecarboxamide?
N-[3-[(2,5-dimethylpyrazol-3-yl)amino]-3-oxopropyl]cyclopentanecarboxamide has a molecular weight of 278.36 g/mol, XLogP of 1.36, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[(2,5-dimethylpyrazol-3-yl)amino]-3-oxopropyl]cyclopentanecarboxamide is sourced from PubChem (CID 38022798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).