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

C17H27N — CID 55107129

IUPACN-methyl-1-[1-[(2,4,6-trimethylphenyl)methyl]cyclopentyl]methanamine
SMILESCNCC1(Cc2c(C)cc(C)cc2C)CCCC1
InChIInChI=1S/C17H27N/c1-13-9-14(2)16(15(3)10-13)11-17(12-18-4)7-5-6-8-17/h9-10,18H,5-8,11-12H2,1-4H3
InChIKeyZBTJJACICIPFJK-UHFFFAOYSA-N
MW245.41 g/mol
LogP3.93
Rot. Bonds4

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

N-methyl-1-[1-[(2,4,6-trimethylphenyl)methyl]cyclopentyl]methanamine (PubChem CID 55107129) has the molecular formula C17H27N and a molecular weight of 245.41 g/mol. Its IUPAC name is N-methyl-1-[1-[(2,4,6-trimethylphenyl)methyl]cyclopentyl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[1-[(2,4,6-trimethylphenyl)methyl]cyclopentyl]methanamine
PubChem CID55107129
Molecular FormulaC17H27N
Molecular Weight245.41 g/mol
Exact Mass245.21
IUPAC NameN-methyl-1-[1-[(2,4,6-trimethylphenyl)methyl]cyclopentyl]methanamine
SMILESCNCC1(Cc2c(C)cc(C)cc2C)CCCC1
InChIInChI=1S/C17H27N/c1-13-9-14(2)16(15(3)10-13)11-17(12-18-4)7-5-6-8-17/h9-10,18H,5-8,11-12H2,1-4H3
InChIKeyZBTJJACICIPFJK-UHFFFAOYSA-N
XLogP3.93
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 ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-methyl-1-[1-[(2,4,6-trimethylphenyl)methyl]cyclohexyl]methanamine
CID 63507984
2-methoxy-N-[[1-[(2,4,6-trimethylphenyl)methyl]cyclopentyl]methyl]ethanamine
CID 63508203
N-[[1-(methylaminomethyl)cyclopropyl]methyl]-1-(2,4,6-trimethylphenyl)methanamine
CID 115244718
N-methyl-1-[1-[(3-methylphenyl)methyl]cyclopentyl]methanamine
CID 62724183
1-[(2,4,6-trimethylphenyl)methyl]cycloheptan-1-amine
CID 55185820
1-[(2,4,6-trimethylphenyl)methyl]cyclooctan-1-amine
CID 80603495
1-[1-[(4-ethylphenyl)methyl]cyclohexyl]-N-methylmethanamine
CID 63507472
2-methyl-1-[(2,4,6-trimethylphenyl)methyl]cyclohexan-1-amine
CID 63408341
[4-[(2,4,6-trimethylphenyl)methyl]piperidin-4-yl]methanol
CID 66024977
1-[1-[(4-bromophenyl)methyl]cyclopentyl]-N-methylmethanamine
CID 62724385
1-[1-[(3-chlorophenyl)methyl]cyclopentyl]-N-methylmethanamine
CID 62726411
2-[1-[2-(2,4,6-trimethylphenyl)ethyl]cyclopentyl]ethanamine
CID 65300447

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[1-[(2,4,6-trimethylphenyl)methyl]cyclopentyl]methanamine?
The IUPAC name of N-methyl-1-[1-[(2,4,6-trimethylphenyl)methyl]cyclopentyl]methanamine (CID 55107129) is N-methyl-1-[1-[(2,4,6-trimethylphenyl)methyl]cyclopentyl]methanamine.
What is the SMILES notation for N-methyl-1-[1-[(2,4,6-trimethylphenyl)methyl]cyclopentyl]methanamine?
The canonical SMILES for N-methyl-1-[1-[(2,4,6-trimethylphenyl)methyl]cyclopentyl]methanamine is CNCC1(Cc2c(C)cc(C)cc2C)CCCC1.
What is the InChIKey of N-methyl-1-[1-[(2,4,6-trimethylphenyl)methyl]cyclopentyl]methanamine?
The InChIKey is ZBTJJACICIPFJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N/c1-13-9-14(2)16(15(3)10-13)11-17(12-18-4)7-5-6-8-17/h9-10,18H,5-8,11-12H2,1-4H3.
What are the key properties of N-methyl-1-[1-[(2,4,6-trimethylphenyl)methyl]cyclopentyl]methanamine?
N-methyl-1-[1-[(2,4,6-trimethylphenyl)methyl]cyclopentyl]methanamine has a molecular weight of 245.41 g/mol, XLogP of 3.93, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[1-[(2,4,6-trimethylphenyl)methyl]cyclopentyl]methanamine is sourced from PubChem (CID 55107129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).