2-(2-aminoethyl)-N-[2-(hydroxymethyl)cyclohexyl]benzamide

C16H24N2O2 — CID 106361498

IUPAC2-(2-aminoethyl)-N-[2-(hydroxymethyl)cyclohexyl]benzamide
SMILESNCCc1ccccc1C(=O)NC1CCCCC1CO
InChIInChI=1S/C16H24N2O2/c17-10-9-12-5-1-3-7-14(12)16(20)18-15-8-4-2-6-13(15)11-19/h1,3,5,7,13,15,19H,2,4,6,8-11,17H2,(H,18,20)
InChIKeyIQOKUWPAEBOMDY-UHFFFAOYSA-N
MW276.38 g/mol
LogP1.47
Rot. Bonds5

About 2-(2-aminoethyl)-N-[2-(hydroxymethyl)cyclohexyl]benzamide

2-(2-aminoethyl)-N-[2-(hydroxymethyl)cyclohexyl]benzamide (PubChem CID 106361498) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is 2-(2-aminoethyl)-N-[2-(hydroxymethyl)cyclohexyl]benzamide.

Molecular Properties

Compound Name2-(2-aminoethyl)-N-[2-(hydroxymethyl)cyclohexyl]benzamide
PubChem CID106361498
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC Name2-(2-aminoethyl)-N-[2-(hydroxymethyl)cyclohexyl]benzamide
SMILESNCCc1ccccc1C(=O)NC1CCCCC1CO
InChIInChI=1S/C16H24N2O2/c17-10-9-12-5-1-3-7-14(12)16(20)18-15-8-4-2-6-13(15)11-19/h1,3,5,7,13,15,19H,2,4,6,8-11,17H2,(H,18,20)
InChIKeyIQOKUWPAEBOMDY-UHFFFAOYSA-N
XLogP1.47
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.47
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-[2-(hydroxymethyl)cyclohexyl]benzamide
CID 103951112
N-[2-(hydroxymethyl)cyclohexyl]-2-sulfanylbenzamide
CID 106367893
N-[2-(hydroxymethyl)cyclohexyl]benzamide
CID 85447885
5-amino-2-fluoro-N-[2-(hydroxymethyl)cyclohexyl]benzamide
CID 106358647
N-[2-(hydroxymethyl)cyclohexyl]-2-prop-2-enoxybenzamide
CID 106364464
2-amino-N-[2-(hydroxymethyl)cyclohexyl]-2-phenylacetamide
CID 103951115
4-N-[2-(hydroxymethyl)cyclohexyl]benzene-1,4-dicarboxamide
CID 103798607
N-[2-(hydroxymethyl)cyclopentyl]-2-iodo-3-methylbenzamide
CID 113254999
N-[2-(hydroxymethyl)cyclopentyl]-2-nitrobenzamide
CID 103751348
4-[[2-(2-aminoethyl)benzoyl]amino]oxolane-3-carboxylic acid
CID 66238525
2-(ethylamino)-N-[2-(hydroxymethyl)cyclopentyl]benzamide
CID 106362523
2-amino-N-[2-(hydroxymethyl)cyclohexyl]-3-methoxybenzamide
CID 106358697

Frequently Asked Questions

What is the IUPAC name of 2-(2-aminoethyl)-N-[2-(hydroxymethyl)cyclohexyl]benzamide?
The IUPAC name of 2-(2-aminoethyl)-N-[2-(hydroxymethyl)cyclohexyl]benzamide (CID 106361498) is 2-(2-aminoethyl)-N-[2-(hydroxymethyl)cyclohexyl]benzamide.
What is the SMILES notation for 2-(2-aminoethyl)-N-[2-(hydroxymethyl)cyclohexyl]benzamide?
The canonical SMILES for 2-(2-aminoethyl)-N-[2-(hydroxymethyl)cyclohexyl]benzamide is NCCc1ccccc1C(=O)NC1CCCCC1CO.
What is the InChIKey of 2-(2-aminoethyl)-N-[2-(hydroxymethyl)cyclohexyl]benzamide?
The InChIKey is IQOKUWPAEBOMDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c17-10-9-12-5-1-3-7-14(12)16(20)18-15-8-4-2-6-13(15)11-19/h1,3,5,7,13,15,19H,2,4,6,8-11,17H2,(H,18,20).
What are the key properties of 2-(2-aminoethyl)-N-[2-(hydroxymethyl)cyclohexyl]benzamide?
2-(2-aminoethyl)-N-[2-(hydroxymethyl)cyclohexyl]benzamide has a molecular weight of 276.38 g/mol, XLogP of 1.47, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminoethyl)-N-[2-(hydroxymethyl)cyclohexyl]benzamide is sourced from PubChem (CID 106361498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).