3-cyclohexyl-N-[1-(hydroxymethyl)cyclohexyl]propanamide

C16H29NO2 — CID 62519861

IUPAC3-cyclohexyl-N-[1-(hydroxymethyl)cyclohexyl]propanamide
SMILESO=C(CCC1CCCCC1)NC1(CO)CCCCC1
InChIInChI=1S/C16H29NO2/c18-13-16(11-5-2-6-12-16)17-15(19)10-9-14-7-3-1-4-8-14/h14,18H,1-13H2,(H,17,19)
InChIKeyCCFAECIGPXRUNK-UHFFFAOYSA-N
MW267.41 g/mol
LogP3.16
Rot. Bonds5

About 3-cyclohexyl-N-[1-(hydroxymethyl)cyclohexyl]propanamide

3-cyclohexyl-N-[1-(hydroxymethyl)cyclohexyl]propanamide (PubChem CID 62519861) has the molecular formula C16H29NO2 and a molecular weight of 267.41 g/mol. Its IUPAC name is 3-cyclohexyl-N-[1-(hydroxymethyl)cyclohexyl]propanamide.

Molecular Properties

Compound Name3-cyclohexyl-N-[1-(hydroxymethyl)cyclohexyl]propanamide
PubChem CID62519861
Molecular FormulaC16H29NO2
Molecular Weight267.41 g/mol
Exact Mass267.22
IUPAC Name3-cyclohexyl-N-[1-(hydroxymethyl)cyclohexyl]propanamide
SMILESO=C(CCC1CCCCC1)NC1(CO)CCCCC1
InChIInChI=1S/C16H29NO2/c18-13-16(11-5-2-6-12-16)17-15(19)10-9-14-7-3-1-4-8-14/h14,18H,1-13H2,(H,17,19)
InChIKeyCCFAECIGPXRUNK-UHFFFAOYSA-N
XLogP3.16
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.41
LogP ≤ 53.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-cyclohexyl-N-[1-(hydroxymethyl)cyclopentyl]propanamide
CID 62517314
3-cyclohexyl-N-[1-(hydroxymethyl)cyclopropyl]propanamide
CID 115764878
3-cyclohexyl-N-[1-(hydroxymethyl)-4-methylcyclohexyl]propanamide
CID 62527693
2-[1-(3-cyclopentylpropanoylamino)cyclopentyl]acetic acid
CID 64671798
2-cyclohexyl-N-[1-(hydroxymethyl)cyclopentyl]acetamide
CID 62518543
2-cyclopentyl-N-[1-(hydroxymethyl)cyclopentyl]acetamide
CID 62517307
1-(3-cyclohexylpropanoylamino)cyclopentane-1-carboxylic acid
CID 43329530
N-[1-(aminomethyl)cyclopentyl]-3-cyclopropylpropanamide
CID 119565149
3-amino-N-[1-(hydroxymethyl)cyclohexyl]propanamide
CID 62553033
N-[4-(chloromethyl)oxan-4-yl]-3-cyclohexylpropanamide
CID 106300473
N-[3-[[1-(hydroxymethyl)cyclopentyl]amino]-3-oxopropyl]cyclopentanecarboxamide
CID 62517380
N-[1-(chloromethyl)-3-methylcyclohexyl]-3-cyclopentylpropanamide
CID 114304094

Frequently Asked Questions

What is the IUPAC name of 3-cyclohexyl-N-[1-(hydroxymethyl)cyclohexyl]propanamide?
The IUPAC name of 3-cyclohexyl-N-[1-(hydroxymethyl)cyclohexyl]propanamide (CID 62519861) is 3-cyclohexyl-N-[1-(hydroxymethyl)cyclohexyl]propanamide.
What is the SMILES notation for 3-cyclohexyl-N-[1-(hydroxymethyl)cyclohexyl]propanamide?
The canonical SMILES for 3-cyclohexyl-N-[1-(hydroxymethyl)cyclohexyl]propanamide is O=C(CCC1CCCCC1)NC1(CO)CCCCC1.
What is the InChIKey of 3-cyclohexyl-N-[1-(hydroxymethyl)cyclohexyl]propanamide?
The InChIKey is CCFAECIGPXRUNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H29NO2/c18-13-16(11-5-2-6-12-16)17-15(19)10-9-14-7-3-1-4-8-14/h14,18H,1-13H2,(H,17,19).
What are the key properties of 3-cyclohexyl-N-[1-(hydroxymethyl)cyclohexyl]propanamide?
3-cyclohexyl-N-[1-(hydroxymethyl)cyclohexyl]propanamide has a molecular weight of 267.41 g/mol, XLogP of 3.16, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclohexyl-N-[1-(hydroxymethyl)cyclohexyl]propanamide is sourced from PubChem (CID 62519861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).