N-methyl-7,8,9,10-tetrahydro-6H-pyrido[2,3-h][3]benzazepin-2-amine

C14H17N3 — CID 46873321

IUPACN-methyl-7,8,9,10-tetrahydro-6H-pyrido[2,3-h][3]benzazepin-2-amine
SMILESCNc1ccc2cc3c(cc2n1)CCNCC3
InChIInChI=1S/C14H17N3/c1-15-14-3-2-12-8-10-4-6-16-7-5-11(10)9-13(12)17-14/h2-3,8-9,16H,4-7H2,1H3,(H,15,17)
InChIKeyMMFSHWZGESMMBC-UHFFFAOYSA-N
MW227.31 g/mol
LogP1.96
Rot. Bonds1

About N-methyl-7,8,9,10-tetrahydro-6H-pyrido[2,3-h][3]benzazepin-2-amine

N-methyl-7,8,9,10-tetrahydro-6H-pyrido[2,3-h][3]benzazepin-2-amine (PubChem CID 46873321) has the molecular formula C14H17N3 and a molecular weight of 227.31 g/mol. Its IUPAC name is N-methyl-7,8,9,10-tetrahydro-6H-pyrido[2,3-h][3]benzazepin-2-amine.

Molecular Properties

Compound NameN-methyl-7,8,9,10-tetrahydro-6H-pyrido[2,3-h][3]benzazepin-2-amine
PubChem CID46873321
Molecular FormulaC14H17N3
Molecular Weight227.31 g/mol
Exact Mass227.14
IUPAC NameN-methyl-7,8,9,10-tetrahydro-6H-pyrido[2,3-h][3]benzazepin-2-amine
SMILESCNc1ccc2cc3c(cc2n1)CCNCC3
InChIInChI=1S/C14H17N3/c1-15-14-3-2-12-8-10-4-6-16-7-5-11(10)9-13(12)17-14/h2-3,8-9,16H,4-7H2,1H3,(H,15,17)
InChIKeyMMFSHWZGESMMBC-UHFFFAOYSA-N
XLogP1.96
TPSA36.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 51.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1,2,3,4-tetrahydropyrido[3,4-b]acridine
CID 87973944
2-chloro-8-methyl-6,7,9,10-tetrahydropyrido[2,3-h][3]benzazepine
CID 46873318
N-methyl-7-propan-2-yloxyquinolin-2-amine
CID 156731577
N-methyl-2-[(4-methylpiperidin-4-yl)methyl]pyrimidin-4-amine
CID 161051585
7-methyl-2,3,4,5-tetrahydro-1H-3-benzazepine
CID 55264670
benzene;7-propan-2-yl-2,3-dihydro-1H-pyrrolo[2,3-b]quinoline
CID 155732217
2-(2,3-dihydro-1H-inden-5-yl)-N-methyl-1H-imidazo[4,5-b]pyridin-5-amine
CID 79817017
N-methyl-6-thiomorpholin-4-ylsulfonylquinolin-2-amine
CID 62143884
2,3,4,5,7,8,9,10-octahydro-1H-benzo[h][3]benzazepine
CID 29078509
1,5,6,7,8,9-hexahydroimidazo[4,5-h][3]benzazepine
CID 46873419
N-methyl-1H-pyrazolo[4,5-b]pyridin-5-amine
CID 144643083
N-methylaniline;piperazine
CID 157393585

Frequently Asked Questions

What is the IUPAC name of N-methyl-7,8,9,10-tetrahydro-6H-pyrido[2,3-h][3]benzazepin-2-amine?
The IUPAC name of N-methyl-7,8,9,10-tetrahydro-6H-pyrido[2,3-h][3]benzazepin-2-amine (CID 46873321) is N-methyl-7,8,9,10-tetrahydro-6H-pyrido[2,3-h][3]benzazepin-2-amine.
What is the SMILES notation for N-methyl-7,8,9,10-tetrahydro-6H-pyrido[2,3-h][3]benzazepin-2-amine?
The canonical SMILES for N-methyl-7,8,9,10-tetrahydro-6H-pyrido[2,3-h][3]benzazepin-2-amine is CNc1ccc2cc3c(cc2n1)CCNCC3.
What is the InChIKey of N-methyl-7,8,9,10-tetrahydro-6H-pyrido[2,3-h][3]benzazepin-2-amine?
The InChIKey is MMFSHWZGESMMBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3/c1-15-14-3-2-12-8-10-4-6-16-7-5-11(10)9-13(12)17-14/h2-3,8-9,16H,4-7H2,1H3,(H,15,17).
What are the key properties of N-methyl-7,8,9,10-tetrahydro-6H-pyrido[2,3-h][3]benzazepin-2-amine?
N-methyl-7,8,9,10-tetrahydro-6H-pyrido[2,3-h][3]benzazepin-2-amine has a molecular weight of 227.31 g/mol, XLogP of 1.96, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-7,8,9,10-tetrahydro-6H-pyrido[2,3-h][3]benzazepin-2-amine is sourced from PubChem (CID 46873321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).