N-(4-hydroxycyclohexyl)-3-piperidin-3-ylbutanamide

C15H28N2O2 — CID 81043560

IUPACN-(4-hydroxycyclohexyl)-3-piperidin-3-ylbutanamide
SMILESCC(CC(=O)NC1CCC(O)CC1)C1CCCNC1
InChIInChI=1S/C15H28N2O2/c1-11(12-3-2-8-16-10-12)9-15(19)17-13-4-6-14(18)7-5-13/h11-14,16,18H,2-10H2,1H3,(H,17,19)
InChIKeyCSYVUCMWGNCCNS-UHFFFAOYSA-N
MW268.40 g/mol
LogP1.43
Rot. Bonds4

About N-(4-hydroxycyclohexyl)-3-piperidin-3-ylbutanamide

N-(4-hydroxycyclohexyl)-3-piperidin-3-ylbutanamide (PubChem CID 81043560) has the molecular formula C15H28N2O2 and a molecular weight of 268.40 g/mol. Its IUPAC name is N-(4-hydroxycyclohexyl)-3-piperidin-3-ylbutanamide.

Molecular Properties

Compound NameN-(4-hydroxycyclohexyl)-3-piperidin-3-ylbutanamide
PubChem CID81043560
Molecular FormulaC15H28N2O2
Molecular Weight268.40 g/mol
Exact Mass268.22
IUPAC NameN-(4-hydroxycyclohexyl)-3-piperidin-3-ylbutanamide
SMILESCC(CC(=O)NC1CCC(O)CC1)C1CCCNC1
InChIInChI=1S/C15H28N2O2/c1-11(12-3-2-8-16-10-12)9-15(19)17-13-4-6-14(18)7-5-13/h11-14,16,18H,2-10H2,1H3,(H,17,19)
InChIKeyCSYVUCMWGNCCNS-UHFFFAOYSA-N
XLogP1.43
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
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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Frequently Asked Questions

What is the IUPAC name of N-(4-hydroxycyclohexyl)-3-piperidin-3-ylbutanamide?
The IUPAC name of N-(4-hydroxycyclohexyl)-3-piperidin-3-ylbutanamide (CID 81043560) is N-(4-hydroxycyclohexyl)-3-piperidin-3-ylbutanamide.
What is the SMILES notation for N-(4-hydroxycyclohexyl)-3-piperidin-3-ylbutanamide?
The canonical SMILES for N-(4-hydroxycyclohexyl)-3-piperidin-3-ylbutanamide is CC(CC(=O)NC1CCC(O)CC1)C1CCCNC1.
What is the InChIKey of N-(4-hydroxycyclohexyl)-3-piperidin-3-ylbutanamide?
The InChIKey is CSYVUCMWGNCCNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O2/c1-11(12-3-2-8-16-10-12)9-15(19)17-13-4-6-14(18)7-5-13/h11-14,16,18H,2-10H2,1H3,(H,17,19).
What are the key properties of N-(4-hydroxycyclohexyl)-3-piperidin-3-ylbutanamide?
N-(4-hydroxycyclohexyl)-3-piperidin-3-ylbutanamide has a molecular weight of 268.40 g/mol, XLogP of 1.43, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydroxycyclohexyl)-3-piperidin-3-ylbutanamide is sourced from PubChem (CID 81043560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).