1-(aminomethyl)-N,4-dimethyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]cyclohexane-1-carboxamide

C15H29N3O2 — CID 106915364

IUPAC1-(aminomethyl)-N,4-dimethyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]cyclohexane-1-carboxamide
SMILESCNC(=O)C(C)CN(C)C(=O)C1(CN)CCC(C)CC1
InChIInChI=1S/C15H29N3O2/c1-11-5-7-15(10-16,8-6-11)14(20)18(4)9-12(2)13(19)17-3/h11-12H,5-10,16H2,1-4H3,(H,17,19)
InChIKeyGBRDUGGSBHIDFU-UHFFFAOYSA-N
MW283.42 g/mol
LogP0.98
Rot. Bonds5

About 1-(aminomethyl)-N,4-dimethyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]cyclohexane-1-carboxamide

1-(aminomethyl)-N,4-dimethyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]cyclohexane-1-carboxamide (PubChem CID 106915364) has the molecular formula C15H29N3O2 and a molecular weight of 283.42 g/mol. Its IUPAC name is 1-(aminomethyl)-N,4-dimethyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]cyclohexane-1-carboxamide.

Molecular Properties

Compound Name1-(aminomethyl)-N,4-dimethyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]cyclohexane-1-carboxamide
PubChem CID106915364
Molecular FormulaC15H29N3O2
Molecular Weight283.42 g/mol
Exact Mass283.23
IUPAC Name1-(aminomethyl)-N,4-dimethyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]cyclohexane-1-carboxamide
SMILESCNC(=O)C(C)CN(C)C(=O)C1(CN)CCC(C)CC1
InChIInChI=1S/C15H29N3O2/c1-11-5-7-15(10-16,8-6-11)14(20)18(4)9-12(2)13(19)17-3/h11-12H,5-10,16H2,1-4H3,(H,17,19)
InChIKeyGBRDUGGSBHIDFU-UHFFFAOYSA-N
XLogP0.98
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 50.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-(aminomethyl)-N,4-dimethyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]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

1-amino-N-methyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]cyclobutane-1-carboxamide
CID 106915391
1-(aminomethyl)-N,4-dimethyl-N-[(2-methylcyclopropyl)methyl]cyclohexane-1-carboxamide
CID 113310523
1-(aminomethyl)-N-(1-cyclopropylethyl)-N,4-dimethylcyclohexane-1-carboxamide
CID 115441526
methyl 3-[[1-(aminomethyl)cyclobutanecarbonyl]-methylamino]-2-methylpropanoate
CID 115448160
1-(aminomethyl)-N-butyl-N,4-dimethylcyclohexane-1-carboxamide
CID 115441330
1-(aminomethyl)-N-(cyclopropylmethyl)-4-methyl-N-propan-2-ylcyclohexane-1-carboxamide
CID 115441989
3-[[2-[1-(aminomethyl)cyclobutyl]acetyl]-methylamino]-N,2-dimethylpropanamide
CID 106915392
1-(aminomethyl)-N-(2-ethoxyethyl)-N,4-dimethylcyclohexane-1-carboxamide
CID 113310546
1-(aminomethyl)-N-[(4-bromophenyl)methyl]-N,4-dimethylcyclohexane-1-carboxamide
CID 115441678
1-(aminomethyl)-N-cyclopropyl-N-ethyl-4-methylcyclohexane-1-carboxamide
CID 115441467
N-methyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]-3-propylpiperidine-3-carboxamide
CID 106915355
2-amino-N,5-dimethyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]cyclohexane-1-carboxamide
CID 106918225

Frequently Asked Questions

What is the IUPAC name of 1-(aminomethyl)-N,4-dimethyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]cyclohexane-1-carboxamide?
The IUPAC name of 1-(aminomethyl)-N,4-dimethyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]cyclohexane-1-carboxamide (CID 106915364) is 1-(aminomethyl)-N,4-dimethyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]cyclohexane-1-carboxamide.
What is the SMILES notation for 1-(aminomethyl)-N,4-dimethyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]cyclohexane-1-carboxamide?
The canonical SMILES for 1-(aminomethyl)-N,4-dimethyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]cyclohexane-1-carboxamide is CNC(=O)C(C)CN(C)C(=O)C1(CN)CCC(C)CC1.
What is the InChIKey of 1-(aminomethyl)-N,4-dimethyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]cyclohexane-1-carboxamide?
The InChIKey is GBRDUGGSBHIDFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O2/c1-11-5-7-15(10-16,8-6-11)14(20)18(4)9-12(2)13(19)17-3/h11-12H,5-10,16H2,1-4H3,(H,17,19).
What are the key properties of 1-(aminomethyl)-N,4-dimethyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]cyclohexane-1-carboxamide?
1-(aminomethyl)-N,4-dimethyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]cyclohexane-1-carboxamide has a molecular weight of 283.42 g/mol, XLogP of 0.98, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(aminomethyl)-N,4-dimethyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]cyclohexane-1-carboxamide is sourced from PubChem (CID 106915364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).