(1-amino-3-methylcyclohexyl)-[2-(2-hydroxyethyl)piperidin-1-yl]methanone

C15H28N2O2 — CID 64548999

IUPAC(1-amino-3-methylcyclohexyl)-[2-(2-hydroxyethyl)piperidin-1-yl]methanone
SMILESCC1CCCC(N)(C(=O)N2CCCCC2CCO)C1
InChIInChI=1S/C15H28N2O2/c1-12-5-4-8-15(16,11-12)14(19)17-9-3-2-6-13(17)7-10-18/h12-13,18H,2-11,16H2,1H3
InChIKeyXRVPHGAVCZYWIX-UHFFFAOYSA-N
MW268.40 g/mol
LogP1.66
Rot. Bonds3

About (1-amino-3-methylcyclohexyl)-[2-(2-hydroxyethyl)piperidin-1-yl]methanone

(1-amino-3-methylcyclohexyl)-[2-(2-hydroxyethyl)piperidin-1-yl]methanone (PubChem CID 64548999) has the molecular formula C15H28N2O2 and a molecular weight of 268.40 g/mol. Its IUPAC name is (1-amino-3-methylcyclohexyl)-[2-(2-hydroxyethyl)piperidin-1-yl]methanone.

Molecular Properties

Compound Name(1-amino-3-methylcyclohexyl)-[2-(2-hydroxyethyl)piperidin-1-yl]methanone
PubChem CID64548999
Molecular FormulaC15H28N2O2
Molecular Weight268.40 g/mol
Exact Mass268.22
IUPAC Name(1-amino-3-methylcyclohexyl)-[2-(2-hydroxyethyl)piperidin-1-yl]methanone
SMILESCC1CCCC(N)(C(=O)N2CCCCC2CCO)C1
InChIInChI=1S/C15H28N2O2/c1-12-5-4-8-15(16,11-12)14(19)17-9-3-2-6-13(17)7-10-18/h12-13,18H,2-11,16H2,1H3
InChIKeyXRVPHGAVCZYWIX-UHFFFAOYSA-N
XLogP1.66
TPSA66.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 51.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(1-amino-3-methylcyclohexyl)-(2-ethylazepan-1-yl)methanone
CID 104689695
1-[2-(2-hydroxyethyl)piperidine-1-carbonyl]-3-methylcyclobutane-1-carbothioamide
CID 80592402
methyl 1-(1-amino-3-methylcyclohexanecarbonyl)piperidine-2-carboxylate
CID 64551881
1-(1-amino-3-methylcyclohexanecarbonyl)pyrrolidine-3-carboxylic acid
CID 64554446
2-(1-aminocyclopentyl)-1-[2-(2-hydroxyethyl)piperidin-1-yl]ethanone
CID 64684748
1-[2-(2-hydroxyethyl)piperidine-1-carbonyl]cyclobutane-1-carbonitrile
CID 80598710
ethyl 1-(1-amino-3-methylcyclohexanecarbonyl)piperidine-4-carboxylate
CID 64550431
(1-amino-3-methylcyclohexyl)-(5-ethyl-2-methylmorpholin-4-yl)methanone
CID 64550855
2-(2-hydroxyethyl)-N-propan-2-ylpiperidine-1-carboxamide
CID 60956630
(1-amino-3-methylcyclohexyl)-thiomorpholin-4-ylmethanone
CID 64550427
(1-amino-3-methylcyclohexyl)-(2-azabicyclo[2.2.1]heptan-2-yl)methanone
CID 64555279
[1-(4-aminophenyl)cyclopropyl]-[2-(2-hydroxyethyl)piperidin-1-yl]methanone
CID 115913231

Frequently Asked Questions

What is the IUPAC name of (1-amino-3-methylcyclohexyl)-[2-(2-hydroxyethyl)piperidin-1-yl]methanone?
The IUPAC name of (1-amino-3-methylcyclohexyl)-[2-(2-hydroxyethyl)piperidin-1-yl]methanone (CID 64548999) is (1-amino-3-methylcyclohexyl)-[2-(2-hydroxyethyl)piperidin-1-yl]methanone.
What is the SMILES notation for (1-amino-3-methylcyclohexyl)-[2-(2-hydroxyethyl)piperidin-1-yl]methanone?
The canonical SMILES for (1-amino-3-methylcyclohexyl)-[2-(2-hydroxyethyl)piperidin-1-yl]methanone is CC1CCCC(N)(C(=O)N2CCCCC2CCO)C1.
What is the InChIKey of (1-amino-3-methylcyclohexyl)-[2-(2-hydroxyethyl)piperidin-1-yl]methanone?
The InChIKey is XRVPHGAVCZYWIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O2/c1-12-5-4-8-15(16,11-12)14(19)17-9-3-2-6-13(17)7-10-18/h12-13,18H,2-11,16H2,1H3.
What are the key properties of (1-amino-3-methylcyclohexyl)-[2-(2-hydroxyethyl)piperidin-1-yl]methanone?
(1-amino-3-methylcyclohexyl)-[2-(2-hydroxyethyl)piperidin-1-yl]methanone has a molecular weight of 268.40 g/mol, XLogP of 1.66, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1-amino-3-methylcyclohexyl)-[2-(2-hydroxyethyl)piperidin-1-yl]methanone is sourced from PubChem (CID 64548999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).