2-[(4-aminocyclohexyl)-ethylamino]-1-piperidin-1-ylethanone

C15H29N3O — CID 79115964

IUPAC2-[(4-aminocyclohexyl)-ethylamino]-1-piperidin-1-ylethanone
SMILESCCN(CC(=O)N1CCCCC1)C1CCC(N)CC1
InChIInChI=1S/C15H29N3O/c1-2-17(14-8-6-13(16)7-9-14)12-15(19)18-10-4-3-5-11-18/h13-14H,2-12,16H2,1H3
InChIKeyBWXWZZYTAAWGNI-UHFFFAOYSA-N
MW267.42 g/mol
LogP1.59
Rot. Bonds4

About 2-[(4-aminocyclohexyl)-ethylamino]-1-piperidin-1-ylethanone

2-[(4-aminocyclohexyl)-ethylamino]-1-piperidin-1-ylethanone (PubChem CID 79115964) has the molecular formula C15H29N3O and a molecular weight of 267.42 g/mol. Its IUPAC name is 2-[(4-aminocyclohexyl)-ethylamino]-1-piperidin-1-ylethanone.

Molecular Properties

Compound Name2-[(4-aminocyclohexyl)-ethylamino]-1-piperidin-1-ylethanone
PubChem CID79115964
Molecular FormulaC15H29N3O
Molecular Weight267.42 g/mol
Exact Mass267.23
IUPAC Name2-[(4-aminocyclohexyl)-ethylamino]-1-piperidin-1-ylethanone
SMILESCCN(CC(=O)N1CCCCC1)C1CCC(N)CC1
InChIInChI=1S/C15H29N3O/c1-2-17(14-8-6-13(16)7-9-14)12-15(19)18-10-4-3-5-11-18/h13-14H,2-12,16H2,1H3
InChIKeyBWXWZZYTAAWGNI-UHFFFAOYSA-N
XLogP1.59
TPSA49.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.42
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[(4-aminocyclohexyl)-ethylamino]-1-piperidin-1-ylethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[(4-aminocyclohexyl)-ethylamino]-1-(4-methylpiperidin-1-yl)ethanone
CID 79115346
2-[(4-aminocyclohexyl)-ethylamino]-1-(2-methylmorpholin-4-yl)ethanone
CID 79116387
N-(4-aminocyclohexyl)-N-ethylazepane-1-carboxamide
CID 79152914
1-[2-[(4-aminocyclohexyl)-ethylamino]acetyl]pyrrolidin-2-one
CID 79116132
2-[cyclopropyl-(2-oxo-2-piperidin-1-ylethyl)amino]acetic acid
CID 54945212
N-cyclobutyl-N-[(4S)-1-[2-[cyclopropyl(ethyl)amino]acetyl]azepan-4-yl]methanesulfonamide
CID 129333764
1-(4-aminopiperidin-1-yl)-4-[cyclohexyl(ethyl)amino]butan-1-one
CID 92924220
2-[3-aminopropyl(cyclopentyl)amino]-1-piperidin-1-ylethanone
CID 43319620
N-(4-aminocyclohexyl)-N-methylpiperidine-1-carboxamide
CID 79154903
1-[2-[ethyl(pyrrolidin-3-yl)amino]acetyl]piperidine-3-carboxamide
CID 63300440
2-[[2-(azepan-1-yl)-2-oxoethyl]-piperidin-4-ylamino]acetamide
CID 60801064
2-(4-aminocyclohexyl)-1-piperidin-1-ylethanone;hydrochloride
CID 165412274

Frequently Asked Questions

What is the IUPAC name of 2-[(4-aminocyclohexyl)-ethylamino]-1-piperidin-1-ylethanone?
The IUPAC name of 2-[(4-aminocyclohexyl)-ethylamino]-1-piperidin-1-ylethanone (CID 79115964) is 2-[(4-aminocyclohexyl)-ethylamino]-1-piperidin-1-ylethanone.
What is the SMILES notation for 2-[(4-aminocyclohexyl)-ethylamino]-1-piperidin-1-ylethanone?
The canonical SMILES for 2-[(4-aminocyclohexyl)-ethylamino]-1-piperidin-1-ylethanone is CCN(CC(=O)N1CCCCC1)C1CCC(N)CC1.
What is the InChIKey of 2-[(4-aminocyclohexyl)-ethylamino]-1-piperidin-1-ylethanone?
The InChIKey is BWXWZZYTAAWGNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O/c1-2-17(14-8-6-13(16)7-9-14)12-15(19)18-10-4-3-5-11-18/h13-14H,2-12,16H2,1H3.
What are the key properties of 2-[(4-aminocyclohexyl)-ethylamino]-1-piperidin-1-ylethanone?
2-[(4-aminocyclohexyl)-ethylamino]-1-piperidin-1-ylethanone has a molecular weight of 267.42 g/mol, XLogP of 1.59, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-aminocyclohexyl)-ethylamino]-1-piperidin-1-ylethanone is sourced from PubChem (CID 79115964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).