N-(3-amino-3-oxopropyl)cyclopentanecarboxamide

C9H16N2O2 — CID 43169260

IUPACN-(3-amino-3-oxopropyl)cyclopentanecarboxamide
SMILESNC(=O)CCNC(=O)C1CCCC1
InChIInChI=1S/C9H16N2O2/c10-8(12)5-6-11-9(13)7-3-1-2-4-7/h7H,1-6H2,(H2,10,12)(H,11,13)
InChIKeyIBRHDGKAPZMULB-UHFFFAOYSA-N
MW184.24 g/mol
LogP0.17
Rot. Bonds4

About N-(3-amino-3-oxopropyl)cyclopentanecarboxamide

N-(3-amino-3-oxopropyl)cyclopentanecarboxamide (PubChem CID 43169260) has the molecular formula C9H16N2O2 and a molecular weight of 184.24 g/mol. Its IUPAC name is N-(3-amino-3-oxopropyl)cyclopentanecarboxamide.

Molecular Properties

Compound NameN-(3-amino-3-oxopropyl)cyclopentanecarboxamide
PubChem CID43169260
Molecular FormulaC9H16N2O2
Molecular Weight184.24 g/mol
Exact Mass184.12
IUPAC NameN-(3-amino-3-oxopropyl)cyclopentanecarboxamide
SMILESNC(=O)CCNC(=O)C1CCCC1
InChIInChI=1S/C9H16N2O2/c10-8(12)5-6-11-9(13)7-3-1-2-4-7/h7H,1-6H2,(H2,10,12)(H,11,13)
InChIKeyIBRHDGKAPZMULB-UHFFFAOYSA-N
XLogP0.17
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.24
LogP ≤ 50.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(3-amino-3-oxopropyl)cyclopentanecarboxamide?
The IUPAC name of N-(3-amino-3-oxopropyl)cyclopentanecarboxamide (CID 43169260) is N-(3-amino-3-oxopropyl)cyclopentanecarboxamide.
What is the SMILES notation for N-(3-amino-3-oxopropyl)cyclopentanecarboxamide?
The canonical SMILES for N-(3-amino-3-oxopropyl)cyclopentanecarboxamide is NC(=O)CCNC(=O)C1CCCC1.
What is the InChIKey of N-(3-amino-3-oxopropyl)cyclopentanecarboxamide?
The InChIKey is IBRHDGKAPZMULB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O2/c10-8(12)5-6-11-9(13)7-3-1-2-4-7/h7H,1-6H2,(H2,10,12)(H,11,13).
What are the key properties of N-(3-amino-3-oxopropyl)cyclopentanecarboxamide?
N-(3-amino-3-oxopropyl)cyclopentanecarboxamide has a molecular weight of 184.24 g/mol, XLogP of 0.17, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-3-oxopropyl)cyclopentanecarboxamide is sourced from PubChem (CID 43169260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).