N-(1-cyclopentylethyl)-2-ethyl-6-methylaniline

C16H25N — CID 63448490

IUPACN-(1-cyclopentylethyl)-2-ethyl-6-methylaniline
SMILESCCc1cccc(C)c1NC(C)C1CCCC1
InChIInChI=1S/C16H25N/c1-4-14-11-7-8-12(2)16(14)17-13(3)15-9-5-6-10-15/h7-8,11,13,15,17H,4-6,9-10H2,1-3H3
InChIKeyGLFCSZDPXDIOFM-UHFFFAOYSA-N
MW231.38 g/mol
LogP4.55
Rot. Bonds4

About N-(1-cyclopentylethyl)-2-ethyl-6-methylaniline

N-(1-cyclopentylethyl)-2-ethyl-6-methylaniline (PubChem CID 63448490) has the molecular formula C16H25N and a molecular weight of 231.38 g/mol. Its IUPAC name is N-(1-cyclopentylethyl)-2-ethyl-6-methylaniline.

Molecular Properties

Compound NameN-(1-cyclopentylethyl)-2-ethyl-6-methylaniline
PubChem CID63448490
Molecular FormulaC16H25N
Molecular Weight231.38 g/mol
Exact Mass231.20
IUPAC NameN-(1-cyclopentylethyl)-2-ethyl-6-methylaniline
SMILESCCc1cccc(C)c1NC(C)C1CCCC1
InChIInChI=1S/C16H25N/c1-4-14-11-7-8-12(2)16(14)17-13(3)15-9-5-6-10-15/h7-8,11,13,15,17H,4-6,9-10H2,1-3H3
InChIKeyGLFCSZDPXDIOFM-UHFFFAOYSA-N
XLogP4.55
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.38
LogP ≤ 54.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-ethyl-6-methyl-N-[1-(1-methylpiperidin-4-yl)ethyl]aniline
CID 54862093
2-ethyl-N-[1-(1-ethylpiperidin-4-yl)ethyl]-6-methylaniline
CID 60924899
2-chloro-N-(1-cyclopentylethyl)-6-methylaniline
CID 66252662
N-cyclopentyl-2-ethyl-6-methylaniline
CID 60924694
N-[cyclopropyl-(4-fluorophenyl)methyl]-2-ethyl-6-methylaniline
CID 63448207
1-cyclohexyl-3-(2-ethyl-6-methylphenyl)urea
CID 3326830
2-[[[(1S)-1-cyclohexylethyl]amino]methyl]-6-methylphenol
CID 113355725
N-(2-ethyl-6-methylphenyl)-2-propan-2-ylpiperidine-1-carboxamide
CID 86800635
1-N-cyclopentyl-4-N-(2-ethyl-6-methylphenyl)cyclohexane-1,4-dicarboxamide
CID 109145846
N-(1-cyclopentylethyl)-2,6-difluoro-3-methylaniline
CID 82816054
N-(2,2-dimethylcyclohexyl)-2-ethyl-6-methylaniline
CID 79837088
2-ethyl-N-(4-methoxycyclohexyl)-6-methylaniline
CID 113414373

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopentylethyl)-2-ethyl-6-methylaniline?
The IUPAC name of N-(1-cyclopentylethyl)-2-ethyl-6-methylaniline (CID 63448490) is N-(1-cyclopentylethyl)-2-ethyl-6-methylaniline.
What is the SMILES notation for N-(1-cyclopentylethyl)-2-ethyl-6-methylaniline?
The canonical SMILES for N-(1-cyclopentylethyl)-2-ethyl-6-methylaniline is CCc1cccc(C)c1NC(C)C1CCCC1.
What is the InChIKey of N-(1-cyclopentylethyl)-2-ethyl-6-methylaniline?
The InChIKey is GLFCSZDPXDIOFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N/c1-4-14-11-7-8-12(2)16(14)17-13(3)15-9-5-6-10-15/h7-8,11,13,15,17H,4-6,9-10H2,1-3H3.
What are the key properties of N-(1-cyclopentylethyl)-2-ethyl-6-methylaniline?
N-(1-cyclopentylethyl)-2-ethyl-6-methylaniline has a molecular weight of 231.38 g/mol, XLogP of 4.55, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopentylethyl)-2-ethyl-6-methylaniline is sourced from PubChem (CID 63448490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).