5,11-dimethyl-6H-pyrido[4,3-b]carbazole-1-carboxamide;hydrochloride

C18H16ClN3O — CID 5351320

IUPAC5,11-dimethyl-6H-pyrido[4,3-b]carbazole-1-carboxamide;hydrochloride
SMILESCc1c2ccnc(C(N)=O)c2c(C)c2c1[nH]c1ccccc12.Cl
InChIInChI=1S/C18H15N3O.ClH/c1-9-11-7-8-20-17(18(19)22)14(11)10(2)15-12-5-3-4-6-13(12)21-16(9)15;/h3-8,21H,1-2H3,(H2,19,22);1H
InChIKeyKYNQVALQBVIVGA-UHFFFAOYSA-N
MW325.80 g/mol
LogP4.01
Rot. Bonds1

About 5,11-dimethyl-6H-pyrido[4,3-b]carbazole-1-carboxamide;hydrochloride

5,11-dimethyl-6H-pyrido[4,3-b]carbazole-1-carboxamide;hydrochloride (PubChem CID 5351320) has the molecular formula C18H16ClN3O and a molecular weight of 325.80 g/mol. Its IUPAC name is 5,11-dimethyl-6H-pyrido[4,3-b]carbazole-1-carboxamide;hydrochloride.

Molecular Properties

Compound Name5,11-dimethyl-6H-pyrido[4,3-b]carbazole-1-carboxamide;hydrochloride
PubChem CID5351320
Molecular FormulaC18H16ClN3O
Molecular Weight325.80 g/mol
Exact Mass325.10
IUPAC Name5,11-dimethyl-6H-pyrido[4,3-b]carbazole-1-carboxamide;hydrochloride
SMILESCc1c2ccnc(C(N)=O)c2c(C)c2c1[nH]c1ccccc12.Cl
InChIInChI=1S/C18H15N3O.ClH/c1-9-11-7-8-20-17(18(19)22)14(11)10(2)15-12-5-3-4-6-13(12)21-16(9)15;/h3-8,21H,1-2H3,(H2,19,22);1H
InChIKeyKYNQVALQBVIVGA-UHFFFAOYSA-N
XLogP4.01
TPSA71.77 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.80
LogP ≤ 54.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5,11-dimethyl-6H-pyrido[4,3-b]carbazole-1-carboxamide;hydrochloride?
The IUPAC name of 5,11-dimethyl-6H-pyrido[4,3-b]carbazole-1-carboxamide;hydrochloride (CID 5351320) is 5,11-dimethyl-6H-pyrido[4,3-b]carbazole-1-carboxamide;hydrochloride.
What is the SMILES notation for 5,11-dimethyl-6H-pyrido[4,3-b]carbazole-1-carboxamide;hydrochloride?
The canonical SMILES for 5,11-dimethyl-6H-pyrido[4,3-b]carbazole-1-carboxamide;hydrochloride is Cc1c2ccnc(C(N)=O)c2c(C)c2c1[nH]c1ccccc12.Cl.
What is the InChIKey of 5,11-dimethyl-6H-pyrido[4,3-b]carbazole-1-carboxamide;hydrochloride?
The InChIKey is KYNQVALQBVIVGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N3O.ClH/c1-9-11-7-8-20-17(18(19)22)14(11)10(2)15-12-5-3-4-6-13(12)21-16(9)15;/h3-8,21H,1-2H3,(H2,19,22);1H.
What are the key properties of 5,11-dimethyl-6H-pyrido[4,3-b]carbazole-1-carboxamide;hydrochloride?
5,11-dimethyl-6H-pyrido[4,3-b]carbazole-1-carboxamide;hydrochloride has a molecular weight of 325.80 g/mol, XLogP of 4.01, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,11-dimethyl-6H-pyrido[4,3-b]carbazole-1-carboxamide;hydrochloride is sourced from PubChem (CID 5351320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).