Camazepam

C19H18ClN3O3 — CID 37367

IUPAC(7-chloro-1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl) N,N-dimethylcarbamate
SMILESCN1C2=C(C=C(C=C2)Cl)C(=NC(C1=O)OC(=O)N(C)C)C3=CC=CC=C3
InChIInChI=1S/C19H18ClN3O3/c1-22(2)19(25)26-17-18(24)23(3)15-10-9-13(20)11-14(15)16(21-17)12-7-5-4-6-8-12/h4-11,17H,1-3H3
InChIKeyPXBVEXGRHZFEOF-UHFFFAOYSA-N
MW371.80 g/mol
LogP2.80
Rot. Bonds3

About Camazepam

Camazepam (PubChem CID 37367) has the molecular formula C19H18ClN3O3 and a molecular weight of 371.80 g/mol. Its IUPAC name is (7-chloro-1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl) N,N-dimethylcarbamate.

Molecular Properties

Compound NameCamazepam
PubChem CID37367
Molecular FormulaC19H18ClN3O3
Molecular Weight371.80 g/mol
Exact Mass371.10
IUPAC Name(7-chloro-1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl) N,N-dimethylcarbamate
SMILESCN1C2=C(C=C(C=C2)Cl)C(=NC(C1=O)OC(=O)N(C)C)C3=CC=CC=C3
InChIInChI=1S/C19H18ClN3O3/c1-22(2)19(25)26-17-18(24)23(3)15-10-9-13(20)11-14(15)16(21-17)12-7-5-4-6-8-12/h4-11,17H,1-3H3
InChIKeyPXBVEXGRHZFEOF-UHFFFAOYSA-N
XLogP2.80
TPSA62.20 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity574

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.80
LogP ≤ 52.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of Camazepam?
The IUPAC name of Camazepam (CID 37367) is (7-chloro-1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl) N,N-dimethylcarbamate.
What is the SMILES notation for Camazepam?
The canonical SMILES for Camazepam is CN1C2=C(C=C(C=C2)Cl)C(=NC(C1=O)OC(=O)N(C)C)C3=CC=CC=C3.
What is the InChIKey of Camazepam?
The InChIKey is PXBVEXGRHZFEOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18ClN3O3/c1-22(2)19(25)26-17-18(24)23(3)15-10-9-13(20)11-14(15)16(21-17)12-7-5-4-6-8-12/h4-11,17H,1-3H3.
What are the key properties of Camazepam?
Camazepam has a molecular weight of 371.80 g/mol, XLogP of 2.80, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for Camazepam is sourced from PubChem (CID 37367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).