N-[1-(hydroxymethyl)-3-methylcyclohexyl]-2-piperidin-3-ylacetamide

C15H28N2O2 — CID 62674573

IUPACN-[1-(hydroxymethyl)-3-methylcyclohexyl]-2-piperidin-3-ylacetamide
SMILESCC1CCCC(CO)(NC(=O)CC2CCCNC2)C1
InChIInChI=1S/C15H28N2O2/c1-12-4-2-6-15(9-12,11-18)17-14(19)8-13-5-3-7-16-10-13/h12-13,16,18H,2-11H2,1H3,(H,17,19)
InChIKeySFFBAEKZSSGPGA-UHFFFAOYSA-N
MW268.40 g/mol
LogP1.43
Rot. Bonds4

About N-[1-(hydroxymethyl)-3-methylcyclohexyl]-2-piperidin-3-ylacetamide

N-[1-(hydroxymethyl)-3-methylcyclohexyl]-2-piperidin-3-ylacetamide (PubChem CID 62674573) has the molecular formula C15H28N2O2 and a molecular weight of 268.40 g/mol. Its IUPAC name is N-[1-(hydroxymethyl)-3-methylcyclohexyl]-2-piperidin-3-ylacetamide.

Molecular Properties

Compound NameN-[1-(hydroxymethyl)-3-methylcyclohexyl]-2-piperidin-3-ylacetamide
PubChem CID62674573
Molecular FormulaC15H28N2O2
Molecular Weight268.40 g/mol
Exact Mass268.22
IUPAC NameN-[1-(hydroxymethyl)-3-methylcyclohexyl]-2-piperidin-3-ylacetamide
SMILESCC1CCCC(CO)(NC(=O)CC2CCCNC2)C1
InChIInChI=1S/C15H28N2O2/c1-12-4-2-6-15(9-12,11-18)17-14(19)8-13-5-3-7-16-10-13/h12-13,16,18H,2-11H2,1H3,(H,17,19)
InChIKeySFFBAEKZSSGPGA-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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Related Compounds

2-[1-[(2-pyrrolidin-3-ylacetyl)amino]cyclobutyl]acetic acid
CID 79845652
N-[1-(hydroxymethyl)-3-methylcyclohexyl]-3-methylbutanamide
CID 62527367
3-(ethylamino)-N-[1-(hydroxymethyl)-3-methylcyclohexyl]propanamide
CID 62835204
2-cyclopentyl-N-[1-(hydroxymethyl)cyclopentyl]acetamide
CID 62517307
2-(2-bicyclo[2.2.1]heptanyl)-N-[1-(hydroxymethyl)-3-methylcyclohexyl]acetamide
CID 62527897
N-[1-(hydroxymethyl)cyclohexyl]-2-piperidin-4-ylacetamide
CID 62551511
2-cyclohexyl-N-[1-(hydroxymethyl)cyclopentyl]acetamide
CID 62518543
N-[1-(hydroxymethyl)-3-methylcyclohexyl]pent-4-enamide
CID 62678355
N-[1-(hydroxymethyl)-3-methylcyclohexyl]-3-methylsulfonylpropanamide
CID 62525990
N-[1-(hydroxymethyl)-3-methylcyclohexyl]-3-propylpiperidine-3-carboxamide
CID 63132987
N-[1-(hydroxymethyl)-3-methylcyclohexyl]-2-(4-methylphenyl)acetamide
CID 62527537
5-amino-N-[1-(hydroxymethyl)-3-methylcyclohexyl]-4-methylpentanamide
CID 82012547

Frequently Asked Questions

What is the IUPAC name of N-[1-(hydroxymethyl)-3-methylcyclohexyl]-2-piperidin-3-ylacetamide?
The IUPAC name of N-[1-(hydroxymethyl)-3-methylcyclohexyl]-2-piperidin-3-ylacetamide (CID 62674573) is N-[1-(hydroxymethyl)-3-methylcyclohexyl]-2-piperidin-3-ylacetamide.
What is the SMILES notation for N-[1-(hydroxymethyl)-3-methylcyclohexyl]-2-piperidin-3-ylacetamide?
The canonical SMILES for N-[1-(hydroxymethyl)-3-methylcyclohexyl]-2-piperidin-3-ylacetamide is CC1CCCC(CO)(NC(=O)CC2CCCNC2)C1.
What is the InChIKey of N-[1-(hydroxymethyl)-3-methylcyclohexyl]-2-piperidin-3-ylacetamide?
The InChIKey is SFFBAEKZSSGPGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O2/c1-12-4-2-6-15(9-12,11-18)17-14(19)8-13-5-3-7-16-10-13/h12-13,16,18H,2-11H2,1H3,(H,17,19).
What are the key properties of N-[1-(hydroxymethyl)-3-methylcyclohexyl]-2-piperidin-3-ylacetamide?
N-[1-(hydroxymethyl)-3-methylcyclohexyl]-2-piperidin-3-ylacetamide 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-[1-(hydroxymethyl)-3-methylcyclohexyl]-2-piperidin-3-ylacetamide is sourced from PubChem (CID 62674573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).