4-[(cyclopropylamino)methyl]-N-ethyl-N-(4-methylphenyl)pyridin-3-amine

C18H23N3 — CID 105073338

IUPAC4-[(cyclopropylamino)methyl]-N-ethyl-N-(4-methylphenyl)pyridin-3-amine
SMILESCCN(c1ccc(C)cc1)c1cnccc1CNC1CC1
InChIInChI=1S/C18H23N3/c1-3-21(17-8-4-14(2)5-9-17)18-13-19-11-10-15(18)12-20-16-6-7-16/h4-5,8-11,13,16,20H,3,6-7,12H2,1-2H3
InChIKeyKASDSKGLXRWHMY-UHFFFAOYSA-N
MW281.40 g/mol
LogP3.80
Rot. Bonds6

About 4-[(cyclopropylamino)methyl]-N-ethyl-N-(4-methylphenyl)pyridin-3-amine

4-[(cyclopropylamino)methyl]-N-ethyl-N-(4-methylphenyl)pyridin-3-amine (PubChem CID 105073338) has the molecular formula C18H23N3 and a molecular weight of 281.40 g/mol. Its IUPAC name is 4-[(cyclopropylamino)methyl]-N-ethyl-N-(4-methylphenyl)pyridin-3-amine.

Molecular Properties

Compound Name4-[(cyclopropylamino)methyl]-N-ethyl-N-(4-methylphenyl)pyridin-3-amine
PubChem CID105073338
Molecular FormulaC18H23N3
Molecular Weight281.40 g/mol
Exact Mass281.19
IUPAC Name4-[(cyclopropylamino)methyl]-N-ethyl-N-(4-methylphenyl)pyridin-3-amine
SMILESCCN(c1ccc(C)cc1)c1cnccc1CNC1CC1
InChIInChI=1S/C18H23N3/c1-3-21(17-8-4-14(2)5-9-17)18-13-19-11-10-15(18)12-20-16-6-7-16/h4-5,8-11,13,16,20H,3,6-7,12H2,1-2H3
InChIKeyKASDSKGLXRWHMY-UHFFFAOYSA-N
XLogP3.80
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-[(cyclopropylamino)methyl]-N-methyl-N-pentan-3-ylpyridin-3-amine
CID 105072999
4-[(cyclopropylamino)methyl]-N-(2,4-dimethylphenyl)-N-methylpyridin-3-amine
CID 105073452
4-[(cyclopropylamino)methyl]-N-methyl-N-(pyridin-4-ylmethyl)pyridin-3-amine
CID 105073052
3-[(cyclopropylamino)methyl]-N-ethyl-N-propan-2-ylpyridin-4-amine
CID 81249309
4-[(cyclopropylamino)methyl]-N-methyl-N-(1-thiophen-2-ylpropan-2-yl)pyridin-3-amine
CID 105074166
3-[(cyclopropylamino)methyl]-N-(2,4-dimethylphenyl)-N-methylpyridin-4-amine
CID 81249862
[3-(N-ethylanilino)-4-pyridinyl]methanol
CID 105066676
3-[(cyclopropylamino)methyl]-N-ethyl-N-(2-methylbutyl)pyridin-4-amine
CID 81247877
2-[(cyclopropylamino)methyl]-N-ethyl-4-fluoro-N-phenylaniline
CID 43313811
3-[(cyclopropylamino)methyl]-N,N-bis(prop-2-enyl)pyridin-4-amine
CID 81250020
N'-[3-[(cyclopropylamino)methyl]-4-pyridinyl]-N,N,N'-trimethylethane-1,2-diamine
CID 81248054
N-[(3-methyl-4-pyridinyl)methyl]-4-phenylcyclohexan-1-amine
CID 114698974

Frequently Asked Questions

What is the IUPAC name of 4-[(cyclopropylamino)methyl]-N-ethyl-N-(4-methylphenyl)pyridin-3-amine?
The IUPAC name of 4-[(cyclopropylamino)methyl]-N-ethyl-N-(4-methylphenyl)pyridin-3-amine (CID 105073338) is 4-[(cyclopropylamino)methyl]-N-ethyl-N-(4-methylphenyl)pyridin-3-amine.
What is the SMILES notation for 4-[(cyclopropylamino)methyl]-N-ethyl-N-(4-methylphenyl)pyridin-3-amine?
The canonical SMILES for 4-[(cyclopropylamino)methyl]-N-ethyl-N-(4-methylphenyl)pyridin-3-amine is CCN(c1ccc(C)cc1)c1cnccc1CNC1CC1.
What is the InChIKey of 4-[(cyclopropylamino)methyl]-N-ethyl-N-(4-methylphenyl)pyridin-3-amine?
The InChIKey is KASDSKGLXRWHMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3/c1-3-21(17-8-4-14(2)5-9-17)18-13-19-11-10-15(18)12-20-16-6-7-16/h4-5,8-11,13,16,20H,3,6-7,12H2,1-2H3.
What are the key properties of 4-[(cyclopropylamino)methyl]-N-ethyl-N-(4-methylphenyl)pyridin-3-amine?
4-[(cyclopropylamino)methyl]-N-ethyl-N-(4-methylphenyl)pyridin-3-amine has a molecular weight of 281.40 g/mol, XLogP of 3.80, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(cyclopropylamino)methyl]-N-ethyl-N-(4-methylphenyl)pyridin-3-amine is sourced from PubChem (CID 105073338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).