N-[2-(cyclohexen-1-yl)ethyl]quinolin-2-amine

C17H20N2 — CID 23799237

IUPACN-[2-(cyclohexen-1-yl)ethyl]quinolin-2-amine
SMILESC1=C(CCNc2ccc3ccccc3n2)CCCC1
InChIInChI=1S/C17H20N2/c1-2-6-14(7-3-1)12-13-18-17-11-10-15-8-4-5-9-16(15)19-17/h4-6,8-11H,1-3,7,12-13H2,(H,18,19)
InChIKeyICTFCKVEOJHCJM-UHFFFAOYSA-N
MW252.36 g/mol
LogP4.54
Rot. Bonds4

About N-[2-(cyclohexen-1-yl)ethyl]quinolin-2-amine

N-[2-(cyclohexen-1-yl)ethyl]quinolin-2-amine (PubChem CID 23799237) has the molecular formula C17H20N2 and a molecular weight of 252.36 g/mol. Its IUPAC name is N-[2-(cyclohexen-1-yl)ethyl]quinolin-2-amine.

Molecular Properties

Compound NameN-[2-(cyclohexen-1-yl)ethyl]quinolin-2-amine
PubChem CID23799237
Molecular FormulaC17H20N2
Molecular Weight252.36 g/mol
Exact Mass252.16
IUPAC NameN-[2-(cyclohexen-1-yl)ethyl]quinolin-2-amine
SMILESC1=C(CCNc2ccc3ccccc3n2)CCCC1
InChIInChI=1S/C17H20N2/c1-2-6-14(7-3-1)12-13-18-17-11-10-15-8-4-5-9-16(15)19-17/h4-6,8-11H,1-3,7,12-13H2,(H,18,19)
InChIKeyICTFCKVEOJHCJM-UHFFFAOYSA-N
XLogP4.54
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 54.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

6-bromo-N-[2-(cyclohexen-1-yl)ethyl]pyridin-2-amine
CID 106193831
N-[2-(cyclohexen-1-yl)ethyl]-2-quinolin-2-ylsulfanylacetamide
CID 2463036
2-[2-(cyclopenten-1-yl)ethylamino]quinoline-4-carbonitrile
CID 103844235
[2-[2-(cyclohexen-1-yl)ethylamino]quinolin-4-yl]-morpholin-4-ylmethanone
CID 75402193
N-cycloheptyl-N'-quinolin-2-ylethane-1,2-diamine
CID 115306733
N-[2-(cyclohexen-1-yl)ethyl]-5-hydrazinylpyridin-2-amine
CID 82055043
N-[2-(cyclopenten-1-yl)ethyl]-2-methylpyrimidin-4-amine
CID 103844199
6-chloro-N-[2-(cyclohexen-1-yl)ethyl]pyrazin-2-amine
CID 103606961
N-[2-(cyclohexen-1-yl)ethyl]-2-piperidin-1-ylpyrimidin-4-amine
CID 112884620
2-N-[2-(cyclohexen-1-yl)ethyl]-4-N-[2-(2-methoxyphenyl)ethyl]pyrimidine-2,4-diamine
CID 112885560
1-[6-[2-(cyclohexen-1-yl)ethylamino]-3-pyridinyl]-3-phenylurea
CID 113010275
N-[2-(cyclohexen-1-yl)ethyl]-6-phenyl-2-pyrrolidin-1-ylpyrimidin-4-amine
CID 112934210

Frequently Asked Questions

What is the IUPAC name of N-[2-(cyclohexen-1-yl)ethyl]quinolin-2-amine?
The IUPAC name of N-[2-(cyclohexen-1-yl)ethyl]quinolin-2-amine (CID 23799237) is N-[2-(cyclohexen-1-yl)ethyl]quinolin-2-amine.
What is the SMILES notation for N-[2-(cyclohexen-1-yl)ethyl]quinolin-2-amine?
The canonical SMILES for N-[2-(cyclohexen-1-yl)ethyl]quinolin-2-amine is C1=C(CCNc2ccc3ccccc3n2)CCCC1.
What is the InChIKey of N-[2-(cyclohexen-1-yl)ethyl]quinolin-2-amine?
The InChIKey is ICTFCKVEOJHCJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2/c1-2-6-14(7-3-1)12-13-18-17-11-10-15-8-4-5-9-16(15)19-17/h4-6,8-11H,1-3,7,12-13H2,(H,18,19).
What are the key properties of N-[2-(cyclohexen-1-yl)ethyl]quinolin-2-amine?
N-[2-(cyclohexen-1-yl)ethyl]quinolin-2-amine has a molecular weight of 252.36 g/mol, XLogP of 4.54, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(cyclohexen-1-yl)ethyl]quinolin-2-amine is sourced from PubChem (CID 23799237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).