2-(aminomethyl)-N-(2-methoxyethyl)-5-methyl-N-(2-methylpropyl)aniline

C15H26N2O — CID 62308997

IUPAC2-(aminomethyl)-N-(2-methoxyethyl)-5-methyl-N-(2-methylpropyl)aniline
SMILESCOCCN(CC(C)C)c1cc(C)ccc1CN
InChIInChI=1S/C15H26N2O/c1-12(2)11-17(7-8-18-4)15-9-13(3)5-6-14(15)10-16/h5-6,9,12H,7-8,10-11,16H2,1-4H3
InChIKeyCYKGJJCBJDMDJL-UHFFFAOYSA-N
MW250.39 g/mol
LogP2.56
Rot. Bonds7

About 2-(aminomethyl)-N-(2-methoxyethyl)-5-methyl-N-(2-methylpropyl)aniline

2-(aminomethyl)-N-(2-methoxyethyl)-5-methyl-N-(2-methylpropyl)aniline (PubChem CID 62308997) has the molecular formula C15H26N2O and a molecular weight of 250.39 g/mol. Its IUPAC name is 2-(aminomethyl)-N-(2-methoxyethyl)-5-methyl-N-(2-methylpropyl)aniline.

Molecular Properties

Compound Name2-(aminomethyl)-N-(2-methoxyethyl)-5-methyl-N-(2-methylpropyl)aniline
PubChem CID62308997
Molecular FormulaC15H26N2O
Molecular Weight250.39 g/mol
Exact Mass250.20
IUPAC Name2-(aminomethyl)-N-(2-methoxyethyl)-5-methyl-N-(2-methylpropyl)aniline
SMILESCOCCN(CC(C)C)c1cc(C)ccc1CN
InChIInChI=1S/C15H26N2O/c1-12(2)11-17(7-8-18-4)15-9-13(3)5-6-14(15)10-16/h5-6,9,12H,7-8,10-11,16H2,1-4H3
InChIKeyCYKGJJCBJDMDJL-UHFFFAOYSA-N
XLogP2.56
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(aminomethyl)-N-(2-methoxyethyl)-5-methyl-N-(2-methylpropyl)aniline 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

N'-[2-(aminomethyl)-5-methylphenyl]-N,N-dimethyl-N'-(2-methylpropyl)ethane-1,2-diamine
CID 55057011
2-[2-methoxyethyl(2-methylpropyl)amino]-4-methylbenzoic acid
CID 62701501
N'-hydroxy-2-[2-methoxyethyl(2-methylpropyl)amino]-4-methylbenzenecarboximidamide
CID 62308822
2-(aminomethyl)-5-bromo-N,N-bis(2-methoxyethyl)aniline
CID 61418446
5-chloro-N-(2-methoxyethyl)-N-(2-methylpropyl)-2-[(propan-2-ylamino)methyl]aniline
CID 114849511
2-(aminomethyl)-N,5-dimethyl-N-(2-propan-2-yloxyethyl)aniline
CID 81052636
2-(aminomethyl)-N,N-dibutyl-5-methylaniline
CID 55057054
2-(1-aminoethyl)-N-(2-methoxyethyl)-N-(2-methylpropyl)aniline
CID 54987089
4,5-dimethoxy-2-N-(2-methoxyethyl)-2-N-(2-methylpropyl)benzene-1,2-diamine
CID 83001129
2-(aminomethyl)-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridin-4-amine
CID 62285332
4-(chloromethyl)-N-(2-methoxyethyl)-2-methyl-N-(2-methylpropyl)aniline
CID 62123152
4-N-(2-methoxyethyl)-2-methyl-4-N-(2-methylpropyl)benzene-1,4-diamine
CID 54987138

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-N-(2-methoxyethyl)-5-methyl-N-(2-methylpropyl)aniline?
The IUPAC name of 2-(aminomethyl)-N-(2-methoxyethyl)-5-methyl-N-(2-methylpropyl)aniline (CID 62308997) is 2-(aminomethyl)-N-(2-methoxyethyl)-5-methyl-N-(2-methylpropyl)aniline.
What is the SMILES notation for 2-(aminomethyl)-N-(2-methoxyethyl)-5-methyl-N-(2-methylpropyl)aniline?
The canonical SMILES for 2-(aminomethyl)-N-(2-methoxyethyl)-5-methyl-N-(2-methylpropyl)aniline is COCCN(CC(C)C)c1cc(C)ccc1CN.
What is the InChIKey of 2-(aminomethyl)-N-(2-methoxyethyl)-5-methyl-N-(2-methylpropyl)aniline?
The InChIKey is CYKGJJCBJDMDJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O/c1-12(2)11-17(7-8-18-4)15-9-13(3)5-6-14(15)10-16/h5-6,9,12H,7-8,10-11,16H2,1-4H3.
What are the key properties of 2-(aminomethyl)-N-(2-methoxyethyl)-5-methyl-N-(2-methylpropyl)aniline?
2-(aminomethyl)-N-(2-methoxyethyl)-5-methyl-N-(2-methylpropyl)aniline has a molecular weight of 250.39 g/mol, XLogP of 2.56, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-N-(2-methoxyethyl)-5-methyl-N-(2-methylpropyl)aniline is sourced from PubChem (CID 62308997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).