N,N-diethyl-7-methyl-1,2,3,4-tetrahydroquinolin-3-amine

C14H22N2 — CID 105473278

IUPACN,N-diethyl-7-methyl-1,2,3,4-tetrahydroquinolin-3-amine
SMILESCCN(CC)C1CNc2cc(C)ccc2C1
InChIInChI=1S/C14H22N2/c1-4-16(5-2)13-9-12-7-6-11(3)8-14(12)15-10-13/h6-8,13,15H,4-5,9-10H2,1-3H3
InChIKeyNSCGDNMZKWICBC-UHFFFAOYSA-N
MW218.34 g/mol
LogP2.67
Rot. Bonds3

About N,N-diethyl-7-methyl-1,2,3,4-tetrahydroquinolin-3-amine

N,N-diethyl-7-methyl-1,2,3,4-tetrahydroquinolin-3-amine (PubChem CID 105473278) has the molecular formula C14H22N2 and a molecular weight of 218.34 g/mol. Its IUPAC name is N,N-diethyl-7-methyl-1,2,3,4-tetrahydroquinolin-3-amine.

Molecular Properties

Compound NameN,N-diethyl-7-methyl-1,2,3,4-tetrahydroquinolin-3-amine
PubChem CID105473278
Molecular FormulaC14H22N2
Molecular Weight218.34 g/mol
Exact Mass218.18
IUPAC NameN,N-diethyl-7-methyl-1,2,3,4-tetrahydroquinolin-3-amine
SMILESCCN(CC)C1CNc2cc(C)ccc2C1
InChIInChI=1S/C14H22N2/c1-4-16(5-2)13-9-12-7-6-11(3)8-14(12)15-10-13/h6-8,13,15H,4-5,9-10H2,1-3H3
InChIKeyNSCGDNMZKWICBC-UHFFFAOYSA-N
XLogP2.67
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.34
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N,N-diethyl-7-methyl-1,2,3,4-tetrahydroquinolin-3-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

7-methyl-1,2,3,4-tetrahydroquinoline-3-carboxylic acid
CID 83753051
4-[(3R)-7-methyl-1,2,3,4-tetrahydroquinolin-3-yl]butanoic acid
CID 129452228
(2S)-2,6-dimethyl-2,3-dihydro-1H-indole
CID 130731712
N,N-diethyl-5-methoxy-1,2,3,4-tetrahydroquinolin-3-amine
CID 105495080
methyl 4-[(3R)-7-methyl-1,2,3,4-tetrahydroquinolin-3-yl]butanoate
CID 129452531
6-methyl-2-propan-2-yl-2,3-dihydro-1H-indole
CID 89025776
3-[(2,5-dimethylphenyl)methyl]-1,2,3,4-tetrahydroquinoline
CID 106777922
8-methyl-2,3,4,5-tetrahydro-1H-1-benzazepine;molecular hydrogen
CID 143099737
N,N,N'-trimethyl-N'-(1,2,3,4-tetrahydroquinolin-3-yl)ethane-1,2-diamine
CID 63694889
ethane;7-methyl-1,2,3,4-tetrahydroquinoline
CID 142224426
3-ethyl-7-methyl-1,2,3,5-tetrahydro-1,5-benzodiazepin-4-one
CID 79291109
2-[[cyclopentyl(ethyl)amino]methyl]-4-methylphenol
CID 82976860

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-7-methyl-1,2,3,4-tetrahydroquinolin-3-amine?
The IUPAC name of N,N-diethyl-7-methyl-1,2,3,4-tetrahydroquinolin-3-amine (CID 105473278) is N,N-diethyl-7-methyl-1,2,3,4-tetrahydroquinolin-3-amine.
What is the SMILES notation for N,N-diethyl-7-methyl-1,2,3,4-tetrahydroquinolin-3-amine?
The canonical SMILES for N,N-diethyl-7-methyl-1,2,3,4-tetrahydroquinolin-3-amine is CCN(CC)C1CNc2cc(C)ccc2C1.
What is the InChIKey of N,N-diethyl-7-methyl-1,2,3,4-tetrahydroquinolin-3-amine?
The InChIKey is NSCGDNMZKWICBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2/c1-4-16(5-2)13-9-12-7-6-11(3)8-14(12)15-10-13/h6-8,13,15H,4-5,9-10H2,1-3H3.
What are the key properties of N,N-diethyl-7-methyl-1,2,3,4-tetrahydroquinolin-3-amine?
N,N-diethyl-7-methyl-1,2,3,4-tetrahydroquinolin-3-amine has a molecular weight of 218.34 g/mol, XLogP of 2.67, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-7-methyl-1,2,3,4-tetrahydroquinolin-3-amine is sourced from PubChem (CID 105473278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).