N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)propan-2-amine

C13H20N2 — CID 61151541

IUPACN-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)propan-2-amine
SMILESCC(C)NCc1ccc2c(c1)CCCN2
InChIInChI=1S/C13H20N2/c1-10(2)15-9-11-5-6-13-12(8-11)4-3-7-14-13/h5-6,8,10,14-15H,3-4,7,9H2,1-2H3
InChIKeyJTTJCOFDBCMWOF-UHFFFAOYSA-N
MW204.32 g/mol
LogP2.54
Rot. Bonds3

About N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)propan-2-amine

N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)propan-2-amine (PubChem CID 61151541) has the molecular formula C13H20N2 and a molecular weight of 204.32 g/mol. Its IUPAC name is N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)propan-2-amine.

Molecular Properties

Compound NameN-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)propan-2-amine
PubChem CID61151541
Molecular FormulaC13H20N2
Molecular Weight204.32 g/mol
Exact Mass204.16
IUPAC NameN-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)propan-2-amine
SMILESCC(C)NCc1ccc2c(c1)CCCN2
InChIInChI=1S/C13H20N2/c1-10(2)15-9-11-5-6-13-12(8-11)4-3-7-14-13/h5-6,8,10,14-15H,3-4,7,9H2,1-2H3
InChIKeyJTTJCOFDBCMWOF-UHFFFAOYSA-N
XLogP2.54
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.32
LogP ≤ 52.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)propan-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-methyl-N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)propan-2-amine
CID 61150349
6-[(propan-2-ylamino)methyl]-3,4-dihydro-1H-quinolin-2-one
CID 82285548
N-(2,3-dihydro-1H-inden-5-ylmethyl)propan-2-amine
CID 43163778
N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)aniline
CID 61149619
1-(2,3,4,5-tetrahydro-1H-1-benzazepin-7-yl)propan-2-ol
CID 105457907
N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)cycloheptanamine
CID 61151262
2,2,2-trifluoro-N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)ethanamine
CID 61150769
2-(propan-2-ylamino)-1-(1,2,3,4-tetrahydroquinolin-6-yl)ethanone
CID 82257733
3-methyl-2-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)butan-1-ol
CID 116997978
6-[2-(4-methylphenyl)ethyl]-1,2,3,4-tetrahydroquinoline
CID 63968254
N-[2-[1-(1,2,3,4-tetrahydroquinolin-6-yl)propan-2-ylamino]ethyl]acetamide
CID 82257098
6-(3,3-dimethylbutyl)-1,2,3,4-tetrahydroquinoline
CID 106778864

Frequently Asked Questions

What is the IUPAC name of N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)propan-2-amine?
The IUPAC name of N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)propan-2-amine (CID 61151541) is N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)propan-2-amine.
What is the SMILES notation for N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)propan-2-amine?
The canonical SMILES for N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)propan-2-amine is CC(C)NCc1ccc2c(c1)CCCN2.
What is the InChIKey of N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)propan-2-amine?
The InChIKey is JTTJCOFDBCMWOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2/c1-10(2)15-9-11-5-6-13-12(8-11)4-3-7-14-13/h5-6,8,10,14-15H,3-4,7,9H2,1-2H3.
What are the key properties of N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)propan-2-amine?
N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)propan-2-amine has a molecular weight of 204.32 g/mol, XLogP of 2.54, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,2,3,4-tetrahydroquinolin-6-ylmethyl)propan-2-amine is sourced from PubChem (CID 61151541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).