N-[2-(hydroxymethyl)cyclohexyl]-3-piperidin-4-ylpropanamide

C15H28N2O2 — CID 106361419

IUPACN-[2-(hydroxymethyl)cyclohexyl]-3-piperidin-4-ylpropanamide
SMILESO=C(CCC1CCNCC1)NC1CCCCC1CO
InChIInChI=1S/C15H28N2O2/c18-11-13-3-1-2-4-14(13)17-15(19)6-5-12-7-9-16-10-8-12/h12-14,16,18H,1-11H2,(H,17,19)
InChIKeyYNLMHPUHPVPDEE-UHFFFAOYSA-N
MW268.40 g/mol
LogP1.43
Rot. Bonds5

About N-[2-(hydroxymethyl)cyclohexyl]-3-piperidin-4-ylpropanamide

N-[2-(hydroxymethyl)cyclohexyl]-3-piperidin-4-ylpropanamide (PubChem CID 106361419) has the molecular formula C15H28N2O2 and a molecular weight of 268.40 g/mol. Its IUPAC name is N-[2-(hydroxymethyl)cyclohexyl]-3-piperidin-4-ylpropanamide.

Molecular Properties

Compound NameN-[2-(hydroxymethyl)cyclohexyl]-3-piperidin-4-ylpropanamide
PubChem CID106361419
Molecular FormulaC15H28N2O2
Molecular Weight268.40 g/mol
Exact Mass268.22
IUPAC NameN-[2-(hydroxymethyl)cyclohexyl]-3-piperidin-4-ylpropanamide
SMILESO=C(CCC1CCNCC1)NC1CCCCC1CO
InChIInChI=1S/C15H28N2O2/c18-11-13-3-1-2-4-14(13)17-15(19)6-5-12-7-9-16-10-8-12/h12-14,16,18H,1-11H2,(H,17,19)
InChIKeyYNLMHPUHPVPDEE-UHFFFAOYSA-N
XLogP1.43
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 51.43
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(hydroxymethyl)cyclopentyl]-3-piperidin-4-ylpropanamide
CID 103876533
N-[2-(hydroxymethyl)cyclohexyl]-3-pyrrolidin-3-ylpropanamide
CID 114178713
N-(2-methylcyclohexyl)-3-piperidin-4-ylpropanamide
CID 62210845
4-cyclohexyl-N-[2-(hydroxymethyl)cyclohexyl]butanamide
CID 103798365
4-[[2-(hydroxymethyl)cyclohexyl]amino]-4-oxobutanoic acid
CID 106359284
N-(2-methylsulfanylcyclopentyl)-3-piperidin-4-ylpropanamide
CID 113343493
4-chloro-N-[2-(hydroxymethyl)cyclohexyl]butanamide
CID 106359885
[(1R,2R)-2-(hydroxymethyl)cyclohexyl]carbamic acid
CID 141194189
N-[2-(hydroxymethyl)cyclopentyl]-3-sulfanylpropanamide
CID 106367884
N-[(1S,2R)-2-(hydroxymethyl)cyclohexyl]pent-4-enamide
CID 89374191
5-chloro-N-[2-(hydroxymethyl)cyclohexyl]pentanamide
CID 106359880
N-[2-(hydroxymethyl)cyclopentyl]-2-piperidin-4-yloxyacetamide
CID 106361337

Frequently Asked Questions

What is the IUPAC name of N-[2-(hydroxymethyl)cyclohexyl]-3-piperidin-4-ylpropanamide?
The IUPAC name of N-[2-(hydroxymethyl)cyclohexyl]-3-piperidin-4-ylpropanamide (CID 106361419) is N-[2-(hydroxymethyl)cyclohexyl]-3-piperidin-4-ylpropanamide.
What is the SMILES notation for N-[2-(hydroxymethyl)cyclohexyl]-3-piperidin-4-ylpropanamide?
The canonical SMILES for N-[2-(hydroxymethyl)cyclohexyl]-3-piperidin-4-ylpropanamide is O=C(CCC1CCNCC1)NC1CCCCC1CO.
What is the InChIKey of N-[2-(hydroxymethyl)cyclohexyl]-3-piperidin-4-ylpropanamide?
The InChIKey is YNLMHPUHPVPDEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O2/c18-11-13-3-1-2-4-14(13)17-15(19)6-5-12-7-9-16-10-8-12/h12-14,16,18H,1-11H2,(H,17,19).
What are the key properties of N-[2-(hydroxymethyl)cyclohexyl]-3-piperidin-4-ylpropanamide?
N-[2-(hydroxymethyl)cyclohexyl]-3-piperidin-4-ylpropanamide has a molecular weight of 268.40 g/mol, XLogP of 1.43, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(hydroxymethyl)cyclohexyl]-3-piperidin-4-ylpropanamide is sourced from PubChem (CID 106361419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).