N-methyl-1-(2-methylcyclopentyl)-2-(4-propan-2-ylphenyl)ethanamine

C18H29N — CID 107188350

IUPACN-methyl-1-(2-methylcyclopentyl)-2-(4-propan-2-ylphenyl)ethanamine
SMILESCNC(Cc1ccc(C(C)C)cc1)C1CCCC1C
InChIInChI=1S/C18H29N/c1-13(2)16-10-8-15(9-11-16)12-18(19-4)17-7-5-6-14(17)3/h8-11,13-14,17-19H,5-7,12H2,1-4H3
InChIKeyYTHCDLARVRSARX-UHFFFAOYSA-N
MW259.44 g/mol
LogP4.38
Rot. Bonds5

About N-methyl-1-(2-methylcyclopentyl)-2-(4-propan-2-ylphenyl)ethanamine

N-methyl-1-(2-methylcyclopentyl)-2-(4-propan-2-ylphenyl)ethanamine (PubChem CID 107188350) has the molecular formula C18H29N and a molecular weight of 259.44 g/mol. Its IUPAC name is N-methyl-1-(2-methylcyclopentyl)-2-(4-propan-2-ylphenyl)ethanamine.

Molecular Properties

Compound NameN-methyl-1-(2-methylcyclopentyl)-2-(4-propan-2-ylphenyl)ethanamine
PubChem CID107188350
Molecular FormulaC18H29N
Molecular Weight259.44 g/mol
Exact Mass259.23
IUPAC NameN-methyl-1-(2-methylcyclopentyl)-2-(4-propan-2-ylphenyl)ethanamine
SMILESCNC(Cc1ccc(C(C)C)cc1)C1CCCC1C
InChIInChI=1S/C18H29N/c1-13(2)16-10-8-15(9-11-16)12-18(19-4)17-7-5-6-14(17)3/h8-11,13-14,17-19H,5-7,12H2,1-4H3
InChIKeyYTHCDLARVRSARX-UHFFFAOYSA-N
XLogP4.38
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.44
LogP ≤ 54.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(4-tert-butylphenyl)-N-methyl-1-(2-methylcyclopentyl)ethanamine
CID 107188307
1-cyclohexyl-N-methyl-2-(4-propan-2-ylphenyl)ethanamine
CID 63413394
2-(2-chlorophenyl)-N-methyl-1-(2-methylcyclopentyl)ethanamine
CID 107179450
1-(2,2-dimethylcyclopentyl)-N-methyl-2-(4-propan-2-ylphenyl)ethanamine
CID 107188347
N-methyl-1-(2-methylcyclopentyl)-2-pyridin-3-ylethanamine
CID 107190771
1-(2,2-dimethylcyclopropyl)-N-methyl-2-(4-propan-2-ylphenyl)ethanamine
CID 107004322
[1-cyclooctyl-2-(4-propan-2-ylphenyl)ethyl]hydrazine
CID 105254967
2-(2-fluorophenyl)-N-methyl-1-(2-methylcyclopentyl)ethanamine
CID 107179552
1-[bromo-(2-methylcyclopentyl)methyl]-4-propan-2-ylbenzene
CID 107182321
2-(4-bromophenyl)-N-methyl-1-(2-methylcyclopropyl)ethanamine
CID 61065850
N-[1-(4-propan-2-ylphenyl)propan-2-yl]cyclopentanamine
CID 82262639
2-cyclopentyl-N-methyl-3-(4-propan-2-ylphenyl)propan-1-amine
CID 112569760

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(2-methylcyclopentyl)-2-(4-propan-2-ylphenyl)ethanamine?
The IUPAC name of N-methyl-1-(2-methylcyclopentyl)-2-(4-propan-2-ylphenyl)ethanamine (CID 107188350) is N-methyl-1-(2-methylcyclopentyl)-2-(4-propan-2-ylphenyl)ethanamine.
What is the SMILES notation for N-methyl-1-(2-methylcyclopentyl)-2-(4-propan-2-ylphenyl)ethanamine?
The canonical SMILES for N-methyl-1-(2-methylcyclopentyl)-2-(4-propan-2-ylphenyl)ethanamine is CNC(Cc1ccc(C(C)C)cc1)C1CCCC1C.
What is the InChIKey of N-methyl-1-(2-methylcyclopentyl)-2-(4-propan-2-ylphenyl)ethanamine?
The InChIKey is YTHCDLARVRSARX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29N/c1-13(2)16-10-8-15(9-11-16)12-18(19-4)17-7-5-6-14(17)3/h8-11,13-14,17-19H,5-7,12H2,1-4H3.
What are the key properties of N-methyl-1-(2-methylcyclopentyl)-2-(4-propan-2-ylphenyl)ethanamine?
N-methyl-1-(2-methylcyclopentyl)-2-(4-propan-2-ylphenyl)ethanamine has a molecular weight of 259.44 g/mol, XLogP of 4.38, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(2-methylcyclopentyl)-2-(4-propan-2-ylphenyl)ethanamine is sourced from PubChem (CID 107188350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).