3-amino-N-[2-(dimethylamino)ethyl]-N-(2-methylpropyl)cyclohexane-1-carboxamide

C15H31N3O — CID 55135498

IUPAC3-amino-N-[2-(dimethylamino)ethyl]-N-(2-methylpropyl)cyclohexane-1-carboxamide
SMILESCC(C)CN(CCN(C)C)C(=O)C1CCCC(N)C1
InChIInChI=1S/C15H31N3O/c1-12(2)11-18(9-8-17(3)4)15(19)13-6-5-7-14(16)10-13/h12-14H,5-11,16H2,1-4H3
InChIKeyFPORNEYWNSZHMK-UHFFFAOYSA-N
MW269.43 g/mol
LogP1.55
Rot. Bonds6

About 3-amino-N-[2-(dimethylamino)ethyl]-N-(2-methylpropyl)cyclohexane-1-carboxamide

3-amino-N-[2-(dimethylamino)ethyl]-N-(2-methylpropyl)cyclohexane-1-carboxamide (PubChem CID 55135498) has the molecular formula C15H31N3O and a molecular weight of 269.43 g/mol. Its IUPAC name is 3-amino-N-[2-(dimethylamino)ethyl]-N-(2-methylpropyl)cyclohexane-1-carboxamide.

Molecular Properties

Compound Name3-amino-N-[2-(dimethylamino)ethyl]-N-(2-methylpropyl)cyclohexane-1-carboxamide
PubChem CID55135498
Molecular FormulaC15H31N3O
Molecular Weight269.43 g/mol
Exact Mass269.25
IUPAC Name3-amino-N-[2-(dimethylamino)ethyl]-N-(2-methylpropyl)cyclohexane-1-carboxamide
SMILESCC(C)CN(CCN(C)C)C(=O)C1CCCC(N)C1
InChIInChI=1S/C15H31N3O/c1-12(2)11-18(9-8-17(3)4)15(19)13-6-5-7-14(16)10-13/h12-14H,5-11,16H2,1-4H3
InChIKeyFPORNEYWNSZHMK-UHFFFAOYSA-N
XLogP1.55
TPSA49.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.43
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-amino-N-[2-(dimethylamino)ethyl]-N-(2-methylpropyl)cyclohexane-1-carboxamide 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

3-amino-N,N-bis(2-methylpropyl)cyclohexane-1-carboxamide
CID 55134536
ethyl 2-[(3-aminocyclohexanecarbonyl)-(2-methylpropyl)amino]acetate
CID 63046601
cis-(1R,3S)-3-amino-N-[2-(dimethylamino)ethyl]-N-[(4-fluorophenyl)methyl]cyclohexane-1-carboxamide
CID 124885891
3-amino-N-butan-2-yl-N-ethylcyclohexane-1-carboxamide
CID 62777350
3-amino-N-[2-(dimethylamino)-2-oxoethyl]-N-propylcyclohexane-1-carboxamide
CID 62776151
N'-[(3-aminocyclohexyl)methyl]-N,N-dimethyl-N'-(2-methylpropyl)ethane-1,2-diamine
CID 63045256
3-amino-N-methyl-N-propylcyclohexane-1-carboxamide
CID 62778074
N-[2-(dimethylamino)ethyl]-6-methyl-N-(2-methylpropyl)piperidine-3-carboxamide
CID 55009006
3-amino-N,N-bis(2-ethoxyethyl)cyclohexane-1-carboxamide
CID 82959930
3-amino-N-methyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]cyclohexane-1-carboxamide
CID 113267257
3-[(3-aminocyclohexanecarbonyl)-methylamino]propanoic acid
CID 63046966
3-amino-N-(cyclohexylmethyl)-N-propylcyclohexane-1-carboxamide
CID 119746849

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[2-(dimethylamino)ethyl]-N-(2-methylpropyl)cyclohexane-1-carboxamide?
The IUPAC name of 3-amino-N-[2-(dimethylamino)ethyl]-N-(2-methylpropyl)cyclohexane-1-carboxamide (CID 55135498) is 3-amino-N-[2-(dimethylamino)ethyl]-N-(2-methylpropyl)cyclohexane-1-carboxamide.
What is the SMILES notation for 3-amino-N-[2-(dimethylamino)ethyl]-N-(2-methylpropyl)cyclohexane-1-carboxamide?
The canonical SMILES for 3-amino-N-[2-(dimethylamino)ethyl]-N-(2-methylpropyl)cyclohexane-1-carboxamide is CC(C)CN(CCN(C)C)C(=O)C1CCCC(N)C1.
What is the InChIKey of 3-amino-N-[2-(dimethylamino)ethyl]-N-(2-methylpropyl)cyclohexane-1-carboxamide?
The InChIKey is FPORNEYWNSZHMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3O/c1-12(2)11-18(9-8-17(3)4)15(19)13-6-5-7-14(16)10-13/h12-14H,5-11,16H2,1-4H3.
What are the key properties of 3-amino-N-[2-(dimethylamino)ethyl]-N-(2-methylpropyl)cyclohexane-1-carboxamide?
3-amino-N-[2-(dimethylamino)ethyl]-N-(2-methylpropyl)cyclohexane-1-carboxamide has a molecular weight of 269.43 g/mol, XLogP of 1.55, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[2-(dimethylamino)ethyl]-N-(2-methylpropyl)cyclohexane-1-carboxamide is sourced from PubChem (CID 55135498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).