2-[(cyclopropylamino)methyl]-N-(4-ethylcyclohexyl)-N-methylpyridin-4-amine

C18H29N3 — CID 62288523

IUPAC2-[(cyclopropylamino)methyl]-N-(4-ethylcyclohexyl)-N-methylpyridin-4-amine
SMILESCCC1CCC(N(C)c2ccnc(CNC3CC3)c2)CC1
InChIInChI=1S/C18H29N3/c1-3-14-4-8-17(9-5-14)21(2)18-10-11-19-16(12-18)13-20-15-6-7-15/h10-12,14-15,17,20H,3-9,13H2,1-2H3
InChIKeyIVWHMMAMCLDIEJ-UHFFFAOYSA-N
MW287.45 g/mol
LogP3.74
Rot. Bonds6

About 2-[(cyclopropylamino)methyl]-N-(4-ethylcyclohexyl)-N-methylpyridin-4-amine

2-[(cyclopropylamino)methyl]-N-(4-ethylcyclohexyl)-N-methylpyridin-4-amine (PubChem CID 62288523) has the molecular formula C18H29N3 and a molecular weight of 287.45 g/mol. Its IUPAC name is 2-[(cyclopropylamino)methyl]-N-(4-ethylcyclohexyl)-N-methylpyridin-4-amine.

Molecular Properties

Compound Name2-[(cyclopropylamino)methyl]-N-(4-ethylcyclohexyl)-N-methylpyridin-4-amine
PubChem CID62288523
Molecular FormulaC18H29N3
Molecular Weight287.45 g/mol
Exact Mass287.24
IUPAC Name2-[(cyclopropylamino)methyl]-N-(4-ethylcyclohexyl)-N-methylpyridin-4-amine
SMILESCCC1CCC(N(C)c2ccnc(CNC3CC3)c2)CC1
InChIInChI=1S/C18H29N3/c1-3-14-4-8-17(9-5-14)21(2)18-10-11-19-16(12-18)13-20-15-6-7-15/h10-12,14-15,17,20H,3-9,13H2,1-2H3
InChIKeyIVWHMMAMCLDIEJ-UHFFFAOYSA-N
XLogP3.74
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.45
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[(cyclopropylamino)methyl]-N-(4-ethylcyclohexyl)-N-methylpyridin-4-amine 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-(aminomethyl)-N-(4-ethylcyclohexyl)-N-methylpyridin-4-amine
CID 55125544
2-[(cyclopropylamino)methyl]-N-(3,5-dimethylphenyl)-N-methylpyridin-4-amine
CID 62293645
3-[(cyclopropylamino)methyl]-N-(4-ethylcyclohexyl)-N-methylpyridin-2-amine
CID 62287807
2-[(cyclopropylamino)methyl]-N-ethyl-N-(2-ethylbutyl)pyridin-4-amine
CID 62293189
4-ethyl-N-(1,2-oxazol-3-ylmethyl)cyclohexan-1-amine
CID 79496315
N-[[4-(4-propan-2-ylpiperidin-1-yl)-2-pyridinyl]methyl]cyclopropanamine
CID 103503016
N-cyclopropyl-N-(cyclopropylmethyl)-2-(ethylaminomethyl)pyridin-4-amine
CID 64520480
N-[(5-bromothiophen-3-yl)methyl]-2-[(cyclopropylamino)methyl]-N-methylpyridin-4-amine
CID 62287412
1-N-ethyl-4-N-methyl-4-N-pyridin-4-ylcyclohexane-1,4-diamine
CID 79122529
[4-[methyl-(4-methylcyclohexyl)amino]-2-pyridinyl]methanol
CID 61437354
N-[[5-[(cyclopropylamino)methyl]thiophen-2-yl]methyl]-4-ethyl-N-methylcyclohexan-1-amine
CID 107555313
N-[[4-(4-ethoxyphenoxy)-2-pyridinyl]methyl]cyclopropanamine
CID 62297962

Frequently Asked Questions

What is the IUPAC name of 2-[(cyclopropylamino)methyl]-N-(4-ethylcyclohexyl)-N-methylpyridin-4-amine?
The IUPAC name of 2-[(cyclopropylamino)methyl]-N-(4-ethylcyclohexyl)-N-methylpyridin-4-amine (CID 62288523) is 2-[(cyclopropylamino)methyl]-N-(4-ethylcyclohexyl)-N-methylpyridin-4-amine.
What is the SMILES notation for 2-[(cyclopropylamino)methyl]-N-(4-ethylcyclohexyl)-N-methylpyridin-4-amine?
The canonical SMILES for 2-[(cyclopropylamino)methyl]-N-(4-ethylcyclohexyl)-N-methylpyridin-4-amine is CCC1CCC(N(C)c2ccnc(CNC3CC3)c2)CC1.
What is the InChIKey of 2-[(cyclopropylamino)methyl]-N-(4-ethylcyclohexyl)-N-methylpyridin-4-amine?
The InChIKey is IVWHMMAMCLDIEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29N3/c1-3-14-4-8-17(9-5-14)21(2)18-10-11-19-16(12-18)13-20-15-6-7-15/h10-12,14-15,17,20H,3-9,13H2,1-2H3.
What are the key properties of 2-[(cyclopropylamino)methyl]-N-(4-ethylcyclohexyl)-N-methylpyridin-4-amine?
2-[(cyclopropylamino)methyl]-N-(4-ethylcyclohexyl)-N-methylpyridin-4-amine has a molecular weight of 287.45 g/mol, XLogP of 3.74, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(cyclopropylamino)methyl]-N-(4-ethylcyclohexyl)-N-methylpyridin-4-amine is sourced from PubChem (CID 62288523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).