N-ethyl-4-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)cyclohexan-1-amine

C18H28N2 — CID 114763315

IUPACN-ethyl-4-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)cyclohexan-1-amine
SMILESCCNC1CCC(N2CC(C)Cc3ccccc32)CC1
InChIInChI=1S/C18H28N2/c1-3-19-16-8-10-17(11-9-16)20-13-14(2)12-15-6-4-5-7-18(15)20/h4-7,14,16-17,19H,3,8-13H2,1-2H3
InChIKeyZORPWTNMHVYHSB-UHFFFAOYSA-N
MW272.44 g/mol
LogP3.61
Rot. Bonds3

About N-ethyl-4-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)cyclohexan-1-amine

N-ethyl-4-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)cyclohexan-1-amine (PubChem CID 114763315) has the molecular formula C18H28N2 and a molecular weight of 272.44 g/mol. Its IUPAC name is N-ethyl-4-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)cyclohexan-1-amine.

Molecular Properties

Compound NameN-ethyl-4-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)cyclohexan-1-amine
PubChem CID114763315
Molecular FormulaC18H28N2
Molecular Weight272.44 g/mol
Exact Mass272.23
IUPAC NameN-ethyl-4-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)cyclohexan-1-amine
SMILESCCNC1CCC(N2CC(C)Cc3ccccc32)CC1
InChIInChI=1S/C18H28N2/c1-3-19-16-8-10-17(11-9-16)20-13-14(2)12-15-6-4-5-7-18(15)20/h4-7,14,16-17,19H,3,8-13H2,1-2H3
InChIKeyZORPWTNMHVYHSB-UHFFFAOYSA-N
XLogP3.61
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.44
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)-N-propylcyclohexan-1-amine
CID 114763316
4-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)cyclohexan-1-one
CID 114762215
(2R,3aS)-2-methyl-2,3,3a,4-tetrahydro-1H-pyrrolo[1,2-a]indole
CID 11298239
(3S)-1,3-dimethyl-3,4-dihydro-2H-quinoline
CID 40526138
3-methyl-1-piperidin-3-yl-3,4-dihydro-2H-quinoline
CID 63524612
N-[3-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)propyl]cyclohexanamine
CID 63502793
[2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)cyclobutyl]methanamine
CID 80999104
N-ethyl-3-methyl-3,4-dihydro-2H-quinoline-1-sulfonamide
CID 110416315
1-(2-bromophenyl)-N-ethylpiperidin-4-amine
CID 60862139
N-methyl-4-(2-methyl-2,3-dihydroindol-1-yl)cyclohexan-1-amine
CID 114762754
N-ethyl-1-(2-fluorophenyl)piperidin-4-amine
CID 43315313
N-ethylcyclopropanamine;phenylmethanamine
CID 143821485

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)cyclohexan-1-amine?
The IUPAC name of N-ethyl-4-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)cyclohexan-1-amine (CID 114763315) is N-ethyl-4-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)cyclohexan-1-amine.
What is the SMILES notation for N-ethyl-4-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)cyclohexan-1-amine?
The canonical SMILES for N-ethyl-4-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)cyclohexan-1-amine is CCNC1CCC(N2CC(C)Cc3ccccc32)CC1.
What is the InChIKey of N-ethyl-4-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)cyclohexan-1-amine?
The InChIKey is ZORPWTNMHVYHSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2/c1-3-19-16-8-10-17(11-9-16)20-13-14(2)12-15-6-4-5-7-18(15)20/h4-7,14,16-17,19H,3,8-13H2,1-2H3.
What are the key properties of N-ethyl-4-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)cyclohexan-1-amine?
N-ethyl-4-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)cyclohexan-1-amine has a molecular weight of 272.44 g/mol, XLogP of 3.61, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)cyclohexan-1-amine is sourced from PubChem (CID 114763315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).