N-methyl-3-[(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]pyridin-2-amine

C17H21N3 — CID 62471854

IUPACN-methyl-3-[(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]pyridin-2-amine
SMILESCNc1ncccc1CN1CCCc2cc(C)ccc21
InChIInChI=1S/C17H21N3/c1-13-7-8-16-14(11-13)6-4-10-20(16)12-15-5-3-9-19-17(15)18-2/h3,5,7-9,11H,4,6,10,12H2,1-2H3,(H,18,19)
InChIKeyPFDCHHRMSKLDMQ-UHFFFAOYSA-N
MW267.38 g/mol
LogP3.38
Rot. Bonds3

About N-methyl-3-[(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]pyridin-2-amine

N-methyl-3-[(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]pyridin-2-amine (PubChem CID 62471854) has the molecular formula C17H21N3 and a molecular weight of 267.38 g/mol. Its IUPAC name is N-methyl-3-[(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]pyridin-2-amine.

Molecular Properties

Compound NameN-methyl-3-[(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]pyridin-2-amine
PubChem CID62471854
Molecular FormulaC17H21N3
Molecular Weight267.38 g/mol
Exact Mass267.17
IUPAC NameN-methyl-3-[(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]pyridin-2-amine
SMILESCNc1ncccc1CN1CCCc2cc(C)ccc21
InChIInChI=1S/C17H21N3/c1-13-7-8-16-14(11-13)6-4-10-20(16)12-15-5-3-9-19-17(15)18-2/h3,5,7-9,11H,4,6,10,12H2,1-2H3,(H,18,19)
InChIKeyPFDCHHRMSKLDMQ-UHFFFAOYSA-N
XLogP3.38
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.38
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-methyl-3-[(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]pyridin-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

Frequently Asked Questions

What is the IUPAC name of N-methyl-3-[(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]pyridin-2-amine?
The IUPAC name of N-methyl-3-[(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]pyridin-2-amine (CID 62471854) is N-methyl-3-[(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]pyridin-2-amine.
What is the SMILES notation for N-methyl-3-[(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]pyridin-2-amine?
The canonical SMILES for N-methyl-3-[(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]pyridin-2-amine is CNc1ncccc1CN1CCCc2cc(C)ccc21.
What is the InChIKey of N-methyl-3-[(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]pyridin-2-amine?
The InChIKey is PFDCHHRMSKLDMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3/c1-13-7-8-16-14(11-13)6-4-10-20(16)12-15-5-3-9-19-17(15)18-2/h3,5,7-9,11H,4,6,10,12H2,1-2H3,(H,18,19).
What are the key properties of N-methyl-3-[(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]pyridin-2-amine?
N-methyl-3-[(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]pyridin-2-amine has a molecular weight of 267.38 g/mol, XLogP of 3.38, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-[(6-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]pyridin-2-amine is sourced from PubChem (CID 62471854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).