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

C18H29N3 — CID 62287807

IUPAC3-[(cyclopropylamino)methyl]-N-(4-ethylcyclohexyl)-N-methylpyridin-2-amine
SMILESCCC1CCC(N(C)c2ncccc2CNC2CC2)CC1
InChIInChI=1S/C18H29N3/c1-3-14-6-10-17(11-7-14)21(2)18-15(5-4-12-19-18)13-20-16-8-9-16/h4-5,12,14,16-17,20H,3,6-11,13H2,1-2H3
InChIKeyIANYWIBAQVOZKW-UHFFFAOYSA-N
MW287.45 g/mol
LogP3.74
Rot. Bonds6

About 3-[(cyclopropylamino)methyl]-N-(4-ethylcyclohexyl)-N-methylpyridin-2-amine

3-[(cyclopropylamino)methyl]-N-(4-ethylcyclohexyl)-N-methylpyridin-2-amine (PubChem CID 62287807) has the molecular formula C18H29N3 and a molecular weight of 287.45 g/mol. Its IUPAC name is 3-[(cyclopropylamino)methyl]-N-(4-ethylcyclohexyl)-N-methylpyridin-2-amine.

Molecular Properties

Compound Name3-[(cyclopropylamino)methyl]-N-(4-ethylcyclohexyl)-N-methylpyridin-2-amine
PubChem CID62287807
Molecular FormulaC18H29N3
Molecular Weight287.45 g/mol
Exact Mass287.24
IUPAC Name3-[(cyclopropylamino)methyl]-N-(4-ethylcyclohexyl)-N-methylpyridin-2-amine
SMILESCCC1CCC(N(C)c2ncccc2CNC2CC2)CC1
InChIInChI=1S/C18H29N3/c1-3-14-6-10-17(11-7-14)21(2)18-15(5-4-12-19-18)13-20-16-8-9-16/h4-5,12,14,16-17,20H,3,6-11,13H2,1-2H3
InChIKeyIANYWIBAQVOZKW-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

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Related Compounds

3-(aminomethyl)-N-(4-ethylcyclohexyl)-N-methylpyridin-2-amine
CID 54947942
3-[(cyclopropylamino)methyl]-N-methyl-N-propan-2-ylpyridin-2-amine
CID 62284786
3-[(cyclopropylamino)methyl]-N,N-bis(2-methylpropyl)pyridin-2-amine
CID 62283336
1-N-ethyl-4-N-methyl-4-N-(3-methyl-2-pyridinyl)cyclohexane-1,4-diamine
CID 79122605
2-[(cyclopropylamino)methyl]-N-(4-ethylcyclohexyl)-N-methylpyridin-4-amine
CID 62288523
N-cyclohexyl-3-(ethylaminomethyl)-N-methylpyridin-2-amine
CID 62285464
N-(cyclobutylmethyl)-3-[(cyclopropylamino)methyl]-N-ethylpyridin-2-amine
CID 107401850
N-cyclohexyl-N-methyl-3-(methylaminomethyl)pyridin-2-amine
CID 62285463
N-cyclopropyl-3-[(cyclopropylamino)methyl]-N-(2-methoxyethyl)pyridin-2-amine
CID 62295318
N-[[2-[cyclohexyl(methyl)amino]-3-pyridinyl]methyl]pyrimidin-2-amine
CID 42148071
N,N-dimethyl-3-[(oxan-4-ylamino)methyl]pyridin-2-amine
CID 29153314
N-methyl-N-(1-methylpiperidin-4-yl)-3-(propylaminomethyl)pyridin-2-amine
CID 62279254

Frequently Asked Questions

What is the IUPAC name of 3-[(cyclopropylamino)methyl]-N-(4-ethylcyclohexyl)-N-methylpyridin-2-amine?
The IUPAC name of 3-[(cyclopropylamino)methyl]-N-(4-ethylcyclohexyl)-N-methylpyridin-2-amine (CID 62287807) is 3-[(cyclopropylamino)methyl]-N-(4-ethylcyclohexyl)-N-methylpyridin-2-amine.
What is the SMILES notation for 3-[(cyclopropylamino)methyl]-N-(4-ethylcyclohexyl)-N-methylpyridin-2-amine?
The canonical SMILES for 3-[(cyclopropylamino)methyl]-N-(4-ethylcyclohexyl)-N-methylpyridin-2-amine is CCC1CCC(N(C)c2ncccc2CNC2CC2)CC1.
What is the InChIKey of 3-[(cyclopropylamino)methyl]-N-(4-ethylcyclohexyl)-N-methylpyridin-2-amine?
The InChIKey is IANYWIBAQVOZKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29N3/c1-3-14-6-10-17(11-7-14)21(2)18-15(5-4-12-19-18)13-20-16-8-9-16/h4-5,12,14,16-17,20H,3,6-11,13H2,1-2H3.
What are the key properties of 3-[(cyclopropylamino)methyl]-N-(4-ethylcyclohexyl)-N-methylpyridin-2-amine?
3-[(cyclopropylamino)methyl]-N-(4-ethylcyclohexyl)-N-methylpyridin-2-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 3-[(cyclopropylamino)methyl]-N-(4-ethylcyclohexyl)-N-methylpyridin-2-amine is sourced from PubChem (CID 62287807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).