N,N-diphenylbenzo[h]quinoline-10-carboxamide

C26H18N2O — CID 102590221

IUPACN,N-diphenylbenzo[h]quinoline-10-carboxamide
SMILESO=C(c1cccc2ccc3cccnc3c12)N(c1ccccc1)c1ccccc1
InChIInChI=1S/C26H18N2O/c29-26(28(21-11-3-1-4-12-21)22-13-5-2-6-14-22)23-15-7-9-19-16-17-20-10-8-18-27-25(20)24(19)23/h1-18H
InChIKeyDQIVVLACPRAYBF-UHFFFAOYSA-N
MW374.44 g/mol
LogP6.37
Rot. Bonds3

About N,N-diphenylbenzo[h]quinoline-10-carboxamide

N,N-diphenylbenzo[h]quinoline-10-carboxamide (PubChem CID 102590221) has the molecular formula C26H18N2O and a molecular weight of 374.44 g/mol. Its IUPAC name is N,N-diphenylbenzo[h]quinoline-10-carboxamide.

Molecular Properties

Compound NameN,N-diphenylbenzo[h]quinoline-10-carboxamide
PubChem CID102590221
Molecular FormulaC26H18N2O
Molecular Weight374.44 g/mol
Exact Mass374.14
IUPAC NameN,N-diphenylbenzo[h]quinoline-10-carboxamide
SMILESO=C(c1cccc2ccc3cccnc3c12)N(c1ccccc1)c1ccccc1
InChIInChI=1S/C26H18N2O/c29-26(28(21-11-3-1-4-12-21)22-13-5-2-6-14-22)23-15-7-9-19-16-17-20-10-8-18-27-25(20)24(19)23/h1-18H
InChIKeyDQIVVLACPRAYBF-UHFFFAOYSA-N
XLogP6.37
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500374.44
LogP ≤ 56.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

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Related Compounds

8-hydroxy-N,N-diphenylquinoline-7-carboxamide;hydrochloride
CID 70164229
palladium;quinoline-8-carboxylic acid
CID 174945118
N-(4-chlorophenyl)-N-quinolin-8-ylbenzamide
CID 138982985
2-[(2-amino-2-oxoethyl)-(quinoline-8-carbonyl)amino]acetic acid
CID 107433551
tris(benzene-1,2,4,5-tetracarboxylic acid);tetrakis(1,10-phenanthroline)
CID 71445169
tris(2-carboxyphenolate);lanthanum(3+);1,10-phenanthroline
CID 139240156
N,N-diphenyl-4-quinolin-8-ylaniline
CID 122210729
phenyl quinoline-8-carboxylate
CID 2227226
2-phenyl-1-quinolin-8-ylethanone
CID 10999362
acetic acid;palladium;bis(1,10-phenanthroline)
CID 11261760
benzo[h]quinolin-10-olate
CID 101433150
pyrimidin-2-yl(quinolin-8-yl)methanone
CID 81220703

Frequently Asked Questions

What is the IUPAC name of N,N-diphenylbenzo[h]quinoline-10-carboxamide?
The IUPAC name of N,N-diphenylbenzo[h]quinoline-10-carboxamide (CID 102590221) is N,N-diphenylbenzo[h]quinoline-10-carboxamide.
What is the SMILES notation for N,N-diphenylbenzo[h]quinoline-10-carboxamide?
The canonical SMILES for N,N-diphenylbenzo[h]quinoline-10-carboxamide is O=C(c1cccc2ccc3cccnc3c12)N(c1ccccc1)c1ccccc1.
What is the InChIKey of N,N-diphenylbenzo[h]quinoline-10-carboxamide?
The InChIKey is DQIVVLACPRAYBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H18N2O/c29-26(28(21-11-3-1-4-12-21)22-13-5-2-6-14-22)23-15-7-9-19-16-17-20-10-8-18-27-25(20)24(19)23/h1-18H.
What are the key properties of N,N-diphenylbenzo[h]quinoline-10-carboxamide?
N,N-diphenylbenzo[h]quinoline-10-carboxamide has a molecular weight of 374.44 g/mol, XLogP of 6.37, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diphenylbenzo[h]quinoline-10-carboxamide is sourced from PubChem (CID 102590221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).