2-methyl-N-[2-(1,2,3,4-tetrahydroquinolin-8-yl)ethyl]cyclopentane-1-carboxamide

C18H26N2O — CID 107176837

IUPAC2-methyl-N-[2-(1,2,3,4-tetrahydroquinolin-8-yl)ethyl]cyclopentane-1-carboxamide
SMILESCC1CCCC1C(=O)NCCc1cccc2c1NCCC2
InChIInChI=1S/C18H26N2O/c1-13-5-2-9-16(13)18(21)20-12-10-15-7-3-6-14-8-4-11-19-17(14)15/h3,6-7,13,16,19H,2,4-5,8-12H2,1H3,(H,20,21)
InChIKeyYBPYMTLQFDFIIR-UHFFFAOYSA-N
MW286.42 g/mol
LogP3.14
Rot. Bonds4

About 2-methyl-N-[2-(1,2,3,4-tetrahydroquinolin-8-yl)ethyl]cyclopentane-1-carboxamide

2-methyl-N-[2-(1,2,3,4-tetrahydroquinolin-8-yl)ethyl]cyclopentane-1-carboxamide (PubChem CID 107176837) has the molecular formula C18H26N2O and a molecular weight of 286.42 g/mol. Its IUPAC name is 2-methyl-N-[2-(1,2,3,4-tetrahydroquinolin-8-yl)ethyl]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name2-methyl-N-[2-(1,2,3,4-tetrahydroquinolin-8-yl)ethyl]cyclopentane-1-carboxamide
PubChem CID107176837
Molecular FormulaC18H26N2O
Molecular Weight286.42 g/mol
Exact Mass286.20
IUPAC Name2-methyl-N-[2-(1,2,3,4-tetrahydroquinolin-8-yl)ethyl]cyclopentane-1-carboxamide
SMILESCC1CCCC1C(=O)NCCc1cccc2c1NCCC2
InChIInChI=1S/C18H26N2O/c1-13-5-2-9-16(13)18(21)20-12-10-15-7-3-6-14-8-4-11-19-17(14)15/h3,6-7,13,16,19H,2,4-5,8-12H2,1H3,(H,20,21)
InChIKeyYBPYMTLQFDFIIR-UHFFFAOYSA-N
XLogP3.14
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.42
LogP ≤ 53.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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Ipravacaine
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N-[(1-phenyl-3,4-dihydro-2H-quinolin-3-yl)methyl]acetamide
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2H-Quinolizine-1-acetamide, octahydro-N-(2,6-dimethylphenyl)-, (1S-trans)-
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CID 71273
N-(cyanomethyl)-4-methyl-2-{3-[2-(piperazin-1-yl)phenyl]phenyl}pentanamide
CID 11132919
N-[[(3R,4S)-1-methyl-4-phenyl-3,4-dihydro-2H-quinolin-3-yl]methyl]propanamide
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N-[(1-ethyl-3,4-dihydro-2H-quinolin-3-yl)methyl]acetamide
CID 137636079

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[2-(1,2,3,4-tetrahydroquinolin-8-yl)ethyl]cyclopentane-1-carboxamide?
The IUPAC name of 2-methyl-N-[2-(1,2,3,4-tetrahydroquinolin-8-yl)ethyl]cyclopentane-1-carboxamide (CID 107176837) is 2-methyl-N-[2-(1,2,3,4-tetrahydroquinolin-8-yl)ethyl]cyclopentane-1-carboxamide.
What is the SMILES notation for 2-methyl-N-[2-(1,2,3,4-tetrahydroquinolin-8-yl)ethyl]cyclopentane-1-carboxamide?
The canonical SMILES for 2-methyl-N-[2-(1,2,3,4-tetrahydroquinolin-8-yl)ethyl]cyclopentane-1-carboxamide is CC1CCCC1C(=O)NCCc1cccc2c1NCCC2.
What is the InChIKey of 2-methyl-N-[2-(1,2,3,4-tetrahydroquinolin-8-yl)ethyl]cyclopentane-1-carboxamide?
The InChIKey is YBPYMTLQFDFIIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O/c1-13-5-2-9-16(13)18(21)20-12-10-15-7-3-6-14-8-4-11-19-17(14)15/h3,6-7,13,16,19H,2,4-5,8-12H2,1H3,(H,20,21).
What are the key properties of 2-methyl-N-[2-(1,2,3,4-tetrahydroquinolin-8-yl)ethyl]cyclopentane-1-carboxamide?
2-methyl-N-[2-(1,2,3,4-tetrahydroquinolin-8-yl)ethyl]cyclopentane-1-carboxamide has a molecular weight of 286.42 g/mol, XLogP of 3.14, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[2-(1,2,3,4-tetrahydroquinolin-8-yl)ethyl]cyclopentane-1-carboxamide is sourced from PubChem (CID 107176837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).