1-cyclopropyl-N-[(1-ethylcyclopropyl)methyl]-1-(4-methylphenyl)methanamine

C17H25N — CID 114099572

IUPAC1-cyclopropyl-N-[(1-ethylcyclopropyl)methyl]-1-(4-methylphenyl)methanamine
SMILESCCC1(CNC(c2ccc(C)cc2)C2CC2)CC1
InChIInChI=1S/C17H25N/c1-3-17(10-11-17)12-18-16(15-8-9-15)14-6-4-13(2)5-7-14/h4-7,15-16,18H,3,8-12H2,1-2H3
InChIKeyPWOWRVOUJZYRAR-UHFFFAOYSA-N
MW243.39 g/mol
LogP4.23
Rot. Bonds6

About 1-cyclopropyl-N-[(1-ethylcyclopropyl)methyl]-1-(4-methylphenyl)methanamine

1-cyclopropyl-N-[(1-ethylcyclopropyl)methyl]-1-(4-methylphenyl)methanamine (PubChem CID 114099572) has the molecular formula C17H25N and a molecular weight of 243.39 g/mol. Its IUPAC name is 1-cyclopropyl-N-[(1-ethylcyclopropyl)methyl]-1-(4-methylphenyl)methanamine.

Molecular Properties

Compound Name1-cyclopropyl-N-[(1-ethylcyclopropyl)methyl]-1-(4-methylphenyl)methanamine
PubChem CID114099572
Molecular FormulaC17H25N
Molecular Weight243.39 g/mol
Exact Mass243.20
IUPAC Name1-cyclopropyl-N-[(1-ethylcyclopropyl)methyl]-1-(4-methylphenyl)methanamine
SMILESCCC1(CNC(c2ccc(C)cc2)C2CC2)CC1
InChIInChI=1S/C17H25N/c1-3-17(10-11-17)12-18-16(15-8-9-15)14-6-4-13(2)5-7-14/h4-7,15-16,18H,3,8-12H2,1-2H3
InChIKeyPWOWRVOUJZYRAR-UHFFFAOYSA-N
XLogP4.23
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.39
LogP ≤ 54.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[(4-methylcyclohexyl)-(4-methylphenyl)methyl]ethanamine
CID 55185680
N-[(4,4-dimethylcyclohexyl)-(4-methylphenyl)methyl]propan-1-amine
CID 65391838
1-cyclopropyl-N-[(1-ethylcyclopropyl)methyl]-1-thiophen-2-ylmethanamine
CID 115898683
1-[cyclopropyl-(4-methylphenyl)methyl]-3-[[1-(hydroxymethyl)cyclopropyl]methyl]urea
CID 71981475
N-[cyclopropyl-(4-methylphenyl)methyl]-3-fluoropropan-1-amine
CID 115898727
3-[[cyclopropyl-(4-methylphenyl)methyl]amino]-N,N-diethylpropanamide
CID 60926869
N-[cyclopropyl-(4-methylphenyl)methyl]-N',N'-diethylpropane-1,3-diamine
CID 43763166
N'-cyclopropyl-N-[cyclopropyl-(4-methylphenyl)methyl]-N'-ethylethane-1,2-diamine
CID 103910587
2-[(1-ethylcyclopropyl)methylamino]-N-(4-methylphenyl)propanamide
CID 103734805
1-cyclopropyl-1-(4-methylphenyl)-N-[(2-methylphenyl)methyl]methanamine
CID 60714029
2-cyclohexyl-N-[cyclopropyl-(4-methylphenyl)methyl]ethanamine
CID 63448573
N-[cyclopropyl-(4-methylphenyl)methyl]-7-methyloctan-1-amine
CID 43771308

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-[(1-ethylcyclopropyl)methyl]-1-(4-methylphenyl)methanamine?
The IUPAC name of 1-cyclopropyl-N-[(1-ethylcyclopropyl)methyl]-1-(4-methylphenyl)methanamine (CID 114099572) is 1-cyclopropyl-N-[(1-ethylcyclopropyl)methyl]-1-(4-methylphenyl)methanamine.
What is the SMILES notation for 1-cyclopropyl-N-[(1-ethylcyclopropyl)methyl]-1-(4-methylphenyl)methanamine?
The canonical SMILES for 1-cyclopropyl-N-[(1-ethylcyclopropyl)methyl]-1-(4-methylphenyl)methanamine is CCC1(CNC(c2ccc(C)cc2)C2CC2)CC1.
What is the InChIKey of 1-cyclopropyl-N-[(1-ethylcyclopropyl)methyl]-1-(4-methylphenyl)methanamine?
The InChIKey is PWOWRVOUJZYRAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N/c1-3-17(10-11-17)12-18-16(15-8-9-15)14-6-4-13(2)5-7-14/h4-7,15-16,18H,3,8-12H2,1-2H3.
What are the key properties of 1-cyclopropyl-N-[(1-ethylcyclopropyl)methyl]-1-(4-methylphenyl)methanamine?
1-cyclopropyl-N-[(1-ethylcyclopropyl)methyl]-1-(4-methylphenyl)methanamine has a molecular weight of 243.39 g/mol, XLogP of 4.23, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-[(1-ethylcyclopropyl)methyl]-1-(4-methylphenyl)methanamine is sourced from PubChem (CID 114099572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).