3-cyclopentyl-N-(4-phenylbutan-2-yl)propanamide

C18H27NO — CID 2931878

IUPAC3-cyclopentyl-N-(4-phenylbutan-2-yl)propanamide
SMILESCC(CCc1ccccc1)NC(=O)CCC1CCCC1
InChIInChI=1S/C18H27NO/c1-15(11-12-16-7-3-2-4-8-16)19-18(20)14-13-17-9-5-6-10-17/h2-4,7-8,15,17H,5-6,9-14H2,1H3,(H,19,20)
InChIKeySBMHSKLBZOGTRT-UHFFFAOYSA-N
MW273.42 g/mol
LogP4.09
Rot. Bonds7

About 3-cyclopentyl-N-(4-phenylbutan-2-yl)propanamide

3-cyclopentyl-N-(4-phenylbutan-2-yl)propanamide (PubChem CID 2931878) has the molecular formula C18H27NO and a molecular weight of 273.42 g/mol. Its IUPAC name is 3-cyclopentyl-N-(4-phenylbutan-2-yl)propanamide.

Molecular Properties

Compound Name3-cyclopentyl-N-(4-phenylbutan-2-yl)propanamide
PubChem CID2931878
Molecular FormulaC18H27NO
Molecular Weight273.42 g/mol
Exact Mass273.21
IUPAC Name3-cyclopentyl-N-(4-phenylbutan-2-yl)propanamide
SMILESCC(CCc1ccccc1)NC(=O)CCC1CCCC1
InChIInChI=1S/C18H27NO/c1-15(11-12-16-7-3-2-4-8-16)19-18(20)14-13-17-9-5-6-10-17/h2-4,7-8,15,17H,5-6,9-14H2,1H3,(H,19,20)
InChIKeySBMHSKLBZOGTRT-UHFFFAOYSA-N
XLogP4.09
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.42
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-cyclopentyl-N-(4-phenylbutan-2-yl)propanamide?
The IUPAC name of 3-cyclopentyl-N-(4-phenylbutan-2-yl)propanamide (CID 2931878) is 3-cyclopentyl-N-(4-phenylbutan-2-yl)propanamide.
What is the SMILES notation for 3-cyclopentyl-N-(4-phenylbutan-2-yl)propanamide?
The canonical SMILES for 3-cyclopentyl-N-(4-phenylbutan-2-yl)propanamide is CC(CCc1ccccc1)NC(=O)CCC1CCCC1.
What is the InChIKey of 3-cyclopentyl-N-(4-phenylbutan-2-yl)propanamide?
The InChIKey is SBMHSKLBZOGTRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27NO/c1-15(11-12-16-7-3-2-4-8-16)19-18(20)14-13-17-9-5-6-10-17/h2-4,7-8,15,17H,5-6,9-14H2,1H3,(H,19,20).
What are the key properties of 3-cyclopentyl-N-(4-phenylbutan-2-yl)propanamide?
3-cyclopentyl-N-(4-phenylbutan-2-yl)propanamide has a molecular weight of 273.42 g/mol, XLogP of 4.09, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopentyl-N-(4-phenylbutan-2-yl)propanamide is sourced from PubChem (CID 2931878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).