N-methyl-5-[(2-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]pyridin-2-amine

C17H21N3 — CID 62182343

IUPACN-methyl-5-[(2-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]pyridin-2-amine
SMILESCNc1ccc(CN2c3ccccc3CCC2C)cn1
InChIInChI=1S/C17H21N3/c1-13-7-9-15-5-3-4-6-16(15)20(13)12-14-8-10-17(18-2)19-11-14/h3-6,8,10-11,13H,7,9,12H2,1-2H3,(H,18,19)
InChIKeyAIAQTWBCCFVTFM-UHFFFAOYSA-N
MW267.38 g/mol
LogP3.46
Rot. Bonds3

About N-methyl-5-[(2-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]pyridin-2-amine

N-methyl-5-[(2-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]pyridin-2-amine (PubChem CID 62182343) has the molecular formula C17H21N3 and a molecular weight of 267.38 g/mol. Its IUPAC name is N-methyl-5-[(2-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]pyridin-2-amine.

Molecular Properties

Compound NameN-methyl-5-[(2-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]pyridin-2-amine
PubChem CID62182343
Molecular FormulaC17H21N3
Molecular Weight267.38 g/mol
Exact Mass267.17
IUPAC NameN-methyl-5-[(2-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]pyridin-2-amine
SMILESCNc1ccc(CN2c3ccccc3CCC2C)cn1
InChIInChI=1S/C17H21N3/c1-13-7-9-15-5-3-4-6-16(15)20(13)12-14-8-10-17(18-2)19-11-14/h3-6,8,10-11,13H,7,9,12H2,1-2H3,(H,18,19)
InChIKeyAIAQTWBCCFVTFM-UHFFFAOYSA-N
XLogP3.46
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 ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-5-[(2-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]pyridin-2-amine?
The IUPAC name of N-methyl-5-[(2-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]pyridin-2-amine (CID 62182343) is N-methyl-5-[(2-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]pyridin-2-amine.
What is the SMILES notation for N-methyl-5-[(2-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]pyridin-2-amine?
The canonical SMILES for N-methyl-5-[(2-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]pyridin-2-amine is CNc1ccc(CN2c3ccccc3CCC2C)cn1.
What is the InChIKey of N-methyl-5-[(2-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]pyridin-2-amine?
The InChIKey is AIAQTWBCCFVTFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3/c1-13-7-9-15-5-3-4-6-16(15)20(13)12-14-8-10-17(18-2)19-11-14/h3-6,8,10-11,13H,7,9,12H2,1-2H3,(H,18,19).
What are the key properties of N-methyl-5-[(2-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]pyridin-2-amine?
N-methyl-5-[(2-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]pyridin-2-amine has a molecular weight of 267.38 g/mol, XLogP of 3.46, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-5-[(2-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]pyridin-2-amine is sourced from PubChem (CID 62182343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).