N-[1-(4-ethyl-6,7-dihydroquinolin-2-yl)ethyl]cyclopropanamine

C16H22N2 — CID 90065150

IUPACN-[1-(4-ethyl-6,7-dihydroquinolin-2-yl)ethyl]cyclopropanamine
SMILESCCc1cc(C(C)NC2CC2)nc2c1=CCCC=2
InChIInChI=1S/C16H22N2/c1-3-12-10-16(11(2)17-13-8-9-13)18-15-7-5-4-6-14(12)15/h6-7,10-11,13,17H,3-5,8-9H2,1-2H3
InChIKeyFKSGIVQGVQWXGX-UHFFFAOYSA-N
MW242.37 g/mol
LogP1.81
Rot. Bonds4

About N-[1-(4-ethyl-6,7-dihydroquinolin-2-yl)ethyl]cyclopropanamine

N-[1-(4-ethyl-6,7-dihydroquinolin-2-yl)ethyl]cyclopropanamine (PubChem CID 90065150) has the molecular formula C16H22N2 and a molecular weight of 242.37 g/mol. Its IUPAC name is N-[1-(4-ethyl-6,7-dihydroquinolin-2-yl)ethyl]cyclopropanamine.

Molecular Properties

Compound NameN-[1-(4-ethyl-6,7-dihydroquinolin-2-yl)ethyl]cyclopropanamine
PubChem CID90065150
Molecular FormulaC16H22N2
Molecular Weight242.37 g/mol
Exact Mass242.18
IUPAC NameN-[1-(4-ethyl-6,7-dihydroquinolin-2-yl)ethyl]cyclopropanamine
SMILESCCc1cc(C(C)NC2CC2)nc2c1=CCCC=2
InChIInChI=1S/C16H22N2/c1-3-12-10-16(11(2)17-13-8-9-13)18-15-7-5-4-6-14(12)15/h6-7,10-11,13,17H,3-5,8-9H2,1-2H3
InChIKeyFKSGIVQGVQWXGX-UHFFFAOYSA-N
XLogP1.81
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.37
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(3Z)-3-[C-(difluoromethyl)-N-methylcarbonimidoyl]-5-methylhexa-1,3,5-trien-2-yl]cyclohexanamine
CID 167055985
3-methyl-N-(4-methylcyclohexa-1,3-dien-1-yl)-5,6,7,8a-tetrahydro-1H-quinolin-8-imine
CID 18644461
2-(4-Methylcyclohexa-1,3-dien-1-yl)-1,8a-dihydroquinoxaline
CID 70815934
2,3-Dimethylidene-5,6,7,8-tetrahydro-1,6-naphthyridine
CID 91024706
(3Z,5E,9E)-8-[(Z)-4-(butan-2-ylamino)but-2-en-2-yl]imino-N-ethyl-6-methylundeca-1,3,5,9-tetraen-2-amine
CID 132185571
1-(4-methylidene-2,3,5,6-tetrahydro-1H-quinolin-8-yl)ethanimine
CID 134364137
2-(1,2-Dihydropyridin-5-yl)-6-(3,4-dihydropyridin-2-yl)-1,2-dihydropyridine
CID 141002624
N'-cyclohexa-2,4-dien-1-yl-N-(5,6-dihydro-4H-indol-2-ylmethyl)propane-1,3-diamine
CID 141103654
5-Methyl-1,8a-dihydroquinoxaline
CID 141816508
(Z,2S,3E)-N-[(5E)-3-but-1-en-2-ylimino-6,8-dimethylnona-1,5,8-trien-2-yl]-3-ethylidene-6,7-dimethylidenenon-4-en-2-amine;ethane;2-methylprop-2-en-1-amine
CID 143344580
N-cyclohexa-1,3-dien-1-yl-4-iminocyclohex-2-en-1-amine;ethane
CID 144447312
2-N-[(4-ethanimidoylcyclohexa-1,3-dien-1-yl)methyl]-6-methylhepta-1,6-diene-2,3-diamine
CID 144648298

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-ethyl-6,7-dihydroquinolin-2-yl)ethyl]cyclopropanamine?
The IUPAC name of N-[1-(4-ethyl-6,7-dihydroquinolin-2-yl)ethyl]cyclopropanamine (CID 90065150) is N-[1-(4-ethyl-6,7-dihydroquinolin-2-yl)ethyl]cyclopropanamine.
What is the SMILES notation for N-[1-(4-ethyl-6,7-dihydroquinolin-2-yl)ethyl]cyclopropanamine?
The canonical SMILES for N-[1-(4-ethyl-6,7-dihydroquinolin-2-yl)ethyl]cyclopropanamine is CCc1cc(C(C)NC2CC2)nc2c1=CCCC=2.
What is the InChIKey of N-[1-(4-ethyl-6,7-dihydroquinolin-2-yl)ethyl]cyclopropanamine?
The InChIKey is FKSGIVQGVQWXGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2/c1-3-12-10-16(11(2)17-13-8-9-13)18-15-7-5-4-6-14(12)15/h6-7,10-11,13,17H,3-5,8-9H2,1-2H3.
What are the key properties of N-[1-(4-ethyl-6,7-dihydroquinolin-2-yl)ethyl]cyclopropanamine?
N-[1-(4-ethyl-6,7-dihydroquinolin-2-yl)ethyl]cyclopropanamine has a molecular weight of 242.37 g/mol, XLogP of 1.81, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-ethyl-6,7-dihydroquinolin-2-yl)ethyl]cyclopropanamine is sourced from PubChem (CID 90065150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).