N,1,3-trimethyl-3a,4,5,6-tetrahydroimidazo[1,2-a][1]benzazepin-4-amine

C15H21N3 — CID 166924415

IUPACN,1,3-trimethyl-3a,4,5,6-tetrahydroimidazo[1,2-a][1]benzazepin-4-amine
SMILESCNC1CCc2ccccc2N2C(C)=CN(C)C12
InChIInChI=1S/C15H21N3/c1-11-10-17(3)15-13(16-2)9-8-12-6-4-5-7-14(12)18(11)15/h4-7,10,13,15-16H,8-9H2,1-3H3
InChIKeySHLSWWVKFMNHIU-UHFFFAOYSA-N
MW243.35 g/mol
LogP2.16
Rot. Bonds1

About N,1,3-trimethyl-3a,4,5,6-tetrahydroimidazo[1,2-a][1]benzazepin-4-amine

N,1,3-trimethyl-3a,4,5,6-tetrahydroimidazo[1,2-a][1]benzazepin-4-amine (PubChem CID 166924415) has the molecular formula C15H21N3 and a molecular weight of 243.35 g/mol. Its IUPAC name is N,1,3-trimethyl-3a,4,5,6-tetrahydroimidazo[1,2-a][1]benzazepin-4-amine.

Molecular Properties

Compound NameN,1,3-trimethyl-3a,4,5,6-tetrahydroimidazo[1,2-a][1]benzazepin-4-amine
PubChem CID166924415
Molecular FormulaC15H21N3
Molecular Weight243.35 g/mol
Exact Mass243.17
IUPAC NameN,1,3-trimethyl-3a,4,5,6-tetrahydroimidazo[1,2-a][1]benzazepin-4-amine
SMILESCNC1CCc2ccccc2N2C(C)=CN(C)C12
InChIInChI=1S/C15H21N3/c1-11-10-17(3)15-13(16-2)9-8-12-6-4-5-7-14(12)18(11)15/h4-7,10,13,15-16H,8-9H2,1-3H3
InChIKeySHLSWWVKFMNHIU-UHFFFAOYSA-N
XLogP2.16
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.35
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,2-dimethyl-6-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)pyrimidin-4-amine
CID 80755891
N-methyl-1-[2-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)phenyl]ethanamine
CID 43284088
N,4-dimethyl-2-[(2-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]cyclohexan-1-amine
CID 63481960
3-(methylamino)-1-phenyl-4,5-dihydro-3H-1-benzazepin-2-one
CID 23554961
[4-methyl-2-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)pyrimidin-5-yl]methanol
CID 83184186
5-methyl-11,12-dihydro-10H-benzo[b][1]benzazocine
CID 58892341
2-methyl-3,4-dihydro-2H-quinolin-1-amine
CID 10103459
methyl 1-phenyl-3,4-dihydro-2H-quinoline-2-carboxylate
CID 11492698
6-methyl-2-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)pyrimidine-4-carbonitrile
CID 107543315
4-methyl-2-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)pyrimidine-5-carboxylic acid
CID 83180870
1-cyclopropyl-N-methyl-2-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)ethanamine
CID 63913854
1-(6-chloro-2-methylpyrimidin-4-yl)-2-methyl-3,4-dihydro-2H-quinoline
CID 55080188

Frequently Asked Questions

What is the IUPAC name of N,1,3-trimethyl-3a,4,5,6-tetrahydroimidazo[1,2-a][1]benzazepin-4-amine?
The IUPAC name of N,1,3-trimethyl-3a,4,5,6-tetrahydroimidazo[1,2-a][1]benzazepin-4-amine (CID 166924415) is N,1,3-trimethyl-3a,4,5,6-tetrahydroimidazo[1,2-a][1]benzazepin-4-amine.
What is the SMILES notation for N,1,3-trimethyl-3a,4,5,6-tetrahydroimidazo[1,2-a][1]benzazepin-4-amine?
The canonical SMILES for N,1,3-trimethyl-3a,4,5,6-tetrahydroimidazo[1,2-a][1]benzazepin-4-amine is CNC1CCc2ccccc2N2C(C)=CN(C)C12.
What is the InChIKey of N,1,3-trimethyl-3a,4,5,6-tetrahydroimidazo[1,2-a][1]benzazepin-4-amine?
The InChIKey is SHLSWWVKFMNHIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3/c1-11-10-17(3)15-13(16-2)9-8-12-6-4-5-7-14(12)18(11)15/h4-7,10,13,15-16H,8-9H2,1-3H3.
What are the key properties of N,1,3-trimethyl-3a,4,5,6-tetrahydroimidazo[1,2-a][1]benzazepin-4-amine?
N,1,3-trimethyl-3a,4,5,6-tetrahydroimidazo[1,2-a][1]benzazepin-4-amine has a molecular weight of 243.35 g/mol, XLogP of 2.16, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,1,3-trimethyl-3a,4,5,6-tetrahydroimidazo[1,2-a][1]benzazepin-4-amine is sourced from PubChem (CID 166924415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).