3-cyclohexylpropanamide

C9H17NO — CID 551691

IUPAC3-cyclohexylpropanamide
SMILESNC(=O)CCC1CCCCC1
InChIInChI=1S/C9H17NO/c10-9(11)7-6-8-4-2-1-3-5-8/h8H,1-7H2,(H2,10,11)
InChIKeyFMNWPBFQLPJWAM-UHFFFAOYSA-N
MW155.24 g/mol
LogP1.83
Rot. Bonds3

About 3-cyclohexylpropanamide

3-cyclohexylpropanamide (PubChem CID 551691) has the molecular formula C9H17NO and a molecular weight of 155.24 g/mol. Its IUPAC name is 3-cyclohexylpropanamide.

Molecular Properties

Compound Name3-cyclohexylpropanamide
PubChem CID551691
Molecular FormulaC9H17NO
Molecular Weight155.24 g/mol
Exact Mass155.13
IUPAC Name3-cyclohexylpropanamide
SMILESNC(=O)CCC1CCCCC1
InChIInChI=1S/C9H17NO/c10-9(11)7-6-8-4-2-1-3-5-8/h8H,1-7H2,(H2,10,11)
InChIKeyFMNWPBFQLPJWAM-UHFFFAOYSA-N
XLogP1.83
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

CID 71113
CID 71113
CID 20125
CID 20125
CID 14283
CID 14283
CID 95078
CID 95078
CID 89270
CID 89270
CID 227417
CID 227417
CID 20126
CID 20126
CID 59353
CID 59353
CID 3041945
CID 3041945
CID 3043304
CID 3043304
CID 548040
CID 548040
CID 5159893
CID 5159893

Frequently Asked Questions

What is the IUPAC name of 3-cyclohexylpropanamide?
The IUPAC name of 3-cyclohexylpropanamide (CID 551691) is 3-cyclohexylpropanamide.
What is the SMILES notation for 3-cyclohexylpropanamide?
The canonical SMILES for 3-cyclohexylpropanamide is NC(=O)CCC1CCCCC1.
What is the InChIKey of 3-cyclohexylpropanamide?
The InChIKey is FMNWPBFQLPJWAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO/c10-9(11)7-6-8-4-2-1-3-5-8/h8H,1-7H2,(H2,10,11).
What are the key properties of 3-cyclohexylpropanamide?
3-cyclohexylpropanamide has a molecular weight of 155.24 g/mol, XLogP of 1.83, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclohexylpropanamide is sourced from PubChem (CID 551691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).