N-(2-cyclopropyl-2-hydroxypropyl)cyclopentanecarboxamide

C12H21NO2 — CID 52992723

IUPACN-(2-cyclopropyl-2-hydroxypropyl)cyclopentanecarboxamide
SMILESCC(O)(CNC(=O)C1CCCC1)C1CC1
InChIInChI=1S/C12H21NO2/c1-12(15,10-6-7-10)8-13-11(14)9-4-2-3-5-9/h9-10,15H,2-8H2,1H3,(H,13,14)
InChIKeyXPYPVBIYZNAPAK-UHFFFAOYSA-N
MW211.30 g/mol
LogP1.45
Rot. Bonds4

About N-(2-cyclopropyl-2-hydroxypropyl)cyclopentanecarboxamide

N-(2-cyclopropyl-2-hydroxypropyl)cyclopentanecarboxamide (PubChem CID 52992723) has the molecular formula C12H21NO2 and a molecular weight of 211.30 g/mol. Its IUPAC name is N-(2-cyclopropyl-2-hydroxypropyl)cyclopentanecarboxamide.

Molecular Properties

Compound NameN-(2-cyclopropyl-2-hydroxypropyl)cyclopentanecarboxamide
PubChem CID52992723
Molecular FormulaC12H21NO2
Molecular Weight211.30 g/mol
Exact Mass211.16
IUPAC NameN-(2-cyclopropyl-2-hydroxypropyl)cyclopentanecarboxamide
SMILESCC(O)(CNC(=O)C1CCCC1)C1CC1
InChIInChI=1S/C12H21NO2/c1-12(15,10-6-7-10)8-13-11(14)9-4-2-3-5-9/h9-10,15H,2-8H2,1H3,(H,13,14)
InChIKeyXPYPVBIYZNAPAK-UHFFFAOYSA-N
XLogP1.45
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.30
LogP ≤ 51.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopropyl-2-hydroxypropyl)cyclopentanecarboxamide?
The IUPAC name of N-(2-cyclopropyl-2-hydroxypropyl)cyclopentanecarboxamide (CID 52992723) is N-(2-cyclopropyl-2-hydroxypropyl)cyclopentanecarboxamide.
What is the SMILES notation for N-(2-cyclopropyl-2-hydroxypropyl)cyclopentanecarboxamide?
The canonical SMILES for N-(2-cyclopropyl-2-hydroxypropyl)cyclopentanecarboxamide is CC(O)(CNC(=O)C1CCCC1)C1CC1.
What is the InChIKey of N-(2-cyclopropyl-2-hydroxypropyl)cyclopentanecarboxamide?
The InChIKey is XPYPVBIYZNAPAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21NO2/c1-12(15,10-6-7-10)8-13-11(14)9-4-2-3-5-9/h9-10,15H,2-8H2,1H3,(H,13,14).
What are the key properties of N-(2-cyclopropyl-2-hydroxypropyl)cyclopentanecarboxamide?
N-(2-cyclopropyl-2-hydroxypropyl)cyclopentanecarboxamide has a molecular weight of 211.30 g/mol, XLogP of 1.45, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopropyl-2-hydroxypropyl)cyclopentanecarboxamide is sourced from PubChem (CID 52992723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).