N-[2-(1,2,3,4-tetrahydroquinolin-6-yl)ethyl]cyclopropanamine

C14H20N2 — CID 82256847

IUPACN-[2-(1,2,3,4-tetrahydroquinolin-6-yl)ethyl]cyclopropanamine
SMILESc1cc2c(cc1CCNC1CC1)CCCN2
InChIInChI=1S/C14H20N2/c1-2-12-10-11(3-6-14(12)16-8-1)7-9-15-13-4-5-13/h3,6,10,13,15-16H,1-2,4-5,7-9H2
InChIKeyMKPJXPQZAXIYJU-UHFFFAOYSA-N
MW216.33 g/mol
LogP2.34
Rot. Bonds4

About N-[2-(1,2,3,4-tetrahydroquinolin-6-yl)ethyl]cyclopropanamine

N-[2-(1,2,3,4-tetrahydroquinolin-6-yl)ethyl]cyclopropanamine (PubChem CID 82256847) has the molecular formula C14H20N2 and a molecular weight of 216.33 g/mol. Its IUPAC name is N-[2-(1,2,3,4-tetrahydroquinolin-6-yl)ethyl]cyclopropanamine.

Molecular Properties

Compound NameN-[2-(1,2,3,4-tetrahydroquinolin-6-yl)ethyl]cyclopropanamine
PubChem CID82256847
Molecular FormulaC14H20N2
Molecular Weight216.33 g/mol
Exact Mass216.16
IUPAC NameN-[2-(1,2,3,4-tetrahydroquinolin-6-yl)ethyl]cyclopropanamine
SMILESc1cc2c(cc1CCNC1CC1)CCCN2
InChIInChI=1S/C14H20N2/c1-2-12-10-11(3-6-14(12)16-8-1)7-9-15-13-4-5-13/h3,6,10,13,15-16H,1-2,4-5,7-9H2
InChIKeyMKPJXPQZAXIYJU-UHFFFAOYSA-N
XLogP2.34
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.33
LogP ≤ 52.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(1,2,3,4-tetrahydroquinolin-6-yl)ethyl]cycloheptanamine
CID 82256808
N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)cycloheptanamine
CID 61151262
6-(2-cyclohexylethyl)-1,2,3,4-tetrahydroquinoline
CID 114192887
6-(2-piperidin-4-ylethyl)-1,2,3,4-tetrahydroquinoline
CID 116997911
6-(cyclobutylmethyl)-1,2,3,4-tetrahydroquinoline
CID 106779249
6-[2-(4-methylphenyl)ethyl]-1,2,3,4-tetrahydroquinoline
CID 63968254
N',N'-dimethyl-N-[2-(1,2,3,4-tetrahydroquinolin-6-yl)ethyl]propane-1,3-diamine
CID 82256820
6-(3,3-dimethylbutyl)-1,2,3,4-tetrahydroquinoline
CID 106778864
4-(1,2,3,4-tetrahydroquinolin-6-yl)butanal
CID 164919422
N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)propan-2-amine
CID 61151541
6-[2-(2,4,6-trimethylphenyl)ethyl]-1,2,3,4-tetrahydroquinoline
CID 63968458
2-(1,2,3,4-tetrahydroquinolin-6-yl)acetonitrile
CID 116997937

Frequently Asked Questions

What is the IUPAC name of N-[2-(1,2,3,4-tetrahydroquinolin-6-yl)ethyl]cyclopropanamine?
The IUPAC name of N-[2-(1,2,3,4-tetrahydroquinolin-6-yl)ethyl]cyclopropanamine (CID 82256847) is N-[2-(1,2,3,4-tetrahydroquinolin-6-yl)ethyl]cyclopropanamine.
What is the SMILES notation for N-[2-(1,2,3,4-tetrahydroquinolin-6-yl)ethyl]cyclopropanamine?
The canonical SMILES for N-[2-(1,2,3,4-tetrahydroquinolin-6-yl)ethyl]cyclopropanamine is c1cc2c(cc1CCNC1CC1)CCCN2.
What is the InChIKey of N-[2-(1,2,3,4-tetrahydroquinolin-6-yl)ethyl]cyclopropanamine?
The InChIKey is MKPJXPQZAXIYJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2/c1-2-12-10-11(3-6-14(12)16-8-1)7-9-15-13-4-5-13/h3,6,10,13,15-16H,1-2,4-5,7-9H2.
What are the key properties of N-[2-(1,2,3,4-tetrahydroquinolin-6-yl)ethyl]cyclopropanamine?
N-[2-(1,2,3,4-tetrahydroquinolin-6-yl)ethyl]cyclopropanamine has a molecular weight of 216.33 g/mol, XLogP of 2.34, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1,2,3,4-tetrahydroquinolin-6-yl)ethyl]cyclopropanamine is sourced from PubChem (CID 82256847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).