1-(2-methylcyclopentyl)-N-[(2,4,6-trimethylphenyl)methyl]methanamine

C17H27N — CID 107417225

IUPAC1-(2-methylcyclopentyl)-N-[(2,4,6-trimethylphenyl)methyl]methanamine
SMILESCc1cc(C)c(CNCC2CCCC2C)c(C)c1
InChIInChI=1S/C17H27N/c1-12-8-14(3)17(15(4)9-12)11-18-10-16-7-5-6-13(16)2/h8-9,13,16,18H,5-7,10-11H2,1-4H3
InChIKeyYQUHJHNYFBGWGO-UHFFFAOYSA-N
MW245.41 g/mol
LogP4.14
Rot. Bonds4

About 1-(2-methylcyclopentyl)-N-[(2,4,6-trimethylphenyl)methyl]methanamine

1-(2-methylcyclopentyl)-N-[(2,4,6-trimethylphenyl)methyl]methanamine (PubChem CID 107417225) has the molecular formula C17H27N and a molecular weight of 245.41 g/mol. Its IUPAC name is 1-(2-methylcyclopentyl)-N-[(2,4,6-trimethylphenyl)methyl]methanamine.

Molecular Properties

Compound Name1-(2-methylcyclopentyl)-N-[(2,4,6-trimethylphenyl)methyl]methanamine
PubChem CID107417225
Molecular FormulaC17H27N
Molecular Weight245.41 g/mol
Exact Mass245.21
IUPAC Name1-(2-methylcyclopentyl)-N-[(2,4,6-trimethylphenyl)methyl]methanamine
SMILESCc1cc(C)c(CNCC2CCCC2C)c(C)c1
InChIInChI=1S/C17H27N/c1-12-8-14(3)17(15(4)9-12)11-18-10-16-7-5-6-13(16)2/h8-9,13,16,18H,5-7,10-11H2,1-4H3
InChIKeyYQUHJHNYFBGWGO-UHFFFAOYSA-N
XLogP4.14
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.41
LogP ≤ 54.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[(3,5-dimethylphenyl)methyl]-1-(2-methylcyclopentyl)methanamine
CID 107417631
N-[(3,5-dimethylphenyl)methyl]-1-(2-methylcyclohexyl)methanamine
CID 63456073
1-(2-methylcyclopentyl)-N-[(4-methylphenyl)methyl]methanamine
CID 107416782
1-(2-methylcyclopentyl)-N-[(5-methyl-3-pyridinyl)methyl]methanamine
CID 107418287
1-(2-methylcyclohexyl)-N-[(4-methylphenyl)methyl]methanamine
CID 63455202
N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-1-(2-methylcyclopentyl)methanamine
CID 107417485
N-[(2-methylcyclopentyl)methyl]-1-(2,4,6-trimethylphenyl)ethanamine
CID 107417014
N-[(3,4-dimethylphenyl)methyl]-1-(2-methylcyclohexyl)methanamine
CID 55194085
N-[(4-fluorophenyl)methyl]-1-(2-methylcyclopentyl)methanamine
CID 107416779
1-(2-methylcyclopentyl)-N-[(2-methyl-1,3-thiazol-5-yl)methyl]methanamine
CID 107417627
1-(2-methylcyclopentyl)-N-[(2-methyl-1H-imidazol-5-yl)methyl]methanamine
CID 107417635
N-[(1,3-dimethylpyrazol-4-yl)methyl]-1-(2-methylcyclopentyl)methanamine
CID 107416867

Frequently Asked Questions

What is the IUPAC name of 1-(2-methylcyclopentyl)-N-[(2,4,6-trimethylphenyl)methyl]methanamine?
The IUPAC name of 1-(2-methylcyclopentyl)-N-[(2,4,6-trimethylphenyl)methyl]methanamine (CID 107417225) is 1-(2-methylcyclopentyl)-N-[(2,4,6-trimethylphenyl)methyl]methanamine.
What is the SMILES notation for 1-(2-methylcyclopentyl)-N-[(2,4,6-trimethylphenyl)methyl]methanamine?
The canonical SMILES for 1-(2-methylcyclopentyl)-N-[(2,4,6-trimethylphenyl)methyl]methanamine is Cc1cc(C)c(CNCC2CCCC2C)c(C)c1.
What is the InChIKey of 1-(2-methylcyclopentyl)-N-[(2,4,6-trimethylphenyl)methyl]methanamine?
The InChIKey is YQUHJHNYFBGWGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N/c1-12-8-14(3)17(15(4)9-12)11-18-10-16-7-5-6-13(16)2/h8-9,13,16,18H,5-7,10-11H2,1-4H3.
What are the key properties of 1-(2-methylcyclopentyl)-N-[(2,4,6-trimethylphenyl)methyl]methanamine?
1-(2-methylcyclopentyl)-N-[(2,4,6-trimethylphenyl)methyl]methanamine has a molecular weight of 245.41 g/mol, XLogP of 4.14, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylcyclopentyl)-N-[(2,4,6-trimethylphenyl)methyl]methanamine is sourced from PubChem (CID 107417225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).