3-methyl-N-pyridin-3-yl-8,9-dihydro-7H-pyrrolo[3,2-f]quinoline-6-carboxamide

C18H18N4O — CID 10335309

IUPAC3-methyl-N-pyridin-3-yl-8,9-dihydro-7H-pyrrolo[3,2-f]quinoline-6-carboxamide
SMILESCn1ccc2c3c(ccc21)N(C(=O)Nc1cccnc1)CCC3
InChIInChI=1S/C18H18N4O/c1-21-11-8-15-14-5-3-10-22(17(14)7-6-16(15)21)18(23)20-13-4-2-9-19-12-13/h2,4,6-9,11-12H,3,5,10H2,1H3,(H,20,23)
InChIKeyPOOWHIHRODVUFI-UHFFFAOYSA-N
MW306.37 g/mol
LogP3.56
Rot. Bonds1

About 3-methyl-N-pyridin-3-yl-8,9-dihydro-7H-pyrrolo[3,2-f]quinoline-6-carboxamide

3-methyl-N-pyridin-3-yl-8,9-dihydro-7H-pyrrolo[3,2-f]quinoline-6-carboxamide (PubChem CID 10335309) has the molecular formula C18H18N4O and a molecular weight of 306.37 g/mol. Its IUPAC name is 3-methyl-N-pyridin-3-yl-8,9-dihydro-7H-pyrrolo[3,2-f]quinoline-6-carboxamide.

Molecular Properties

Compound Name3-methyl-N-pyridin-3-yl-8,9-dihydro-7H-pyrrolo[3,2-f]quinoline-6-carboxamide
PubChem CID10335309
Molecular FormulaC18H18N4O
Molecular Weight306.37 g/mol
Exact Mass306.15
IUPAC Name3-methyl-N-pyridin-3-yl-8,9-dihydro-7H-pyrrolo[3,2-f]quinoline-6-carboxamide
SMILESCn1ccc2c3c(ccc21)N(C(=O)Nc1cccnc1)CCC3
InChIInChI=1S/C18H18N4O/c1-21-11-8-15-14-5-3-10-22(17(14)7-6-16(15)21)18(23)20-13-4-2-9-19-12-13/h2,4,6-9,11-12H,3,5,10H2,1H3,(H,20,23)
InChIKeyPOOWHIHRODVUFI-UHFFFAOYSA-N
XLogP3.56
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.37
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 28864
Terguride
CID 443951
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CID 5163
PF-750
CID 25154868
1,3-Di-6-quinolylurea
CID 68281
Florquinitau
CID 118577045
1-Methyl-3-quinolin-8-ylurea
CID 250561
SB 200646 hydrochloride
CID 5311422
N-(1-Methyl-1H-indol-5-yl)-N'-3-pyridinylurea
CID 126769
N-[4-(1-azepanyl)benzyl]-N'-(3-methyl-5-isoquinolinyl)urea
CID 9977590
N-[3-fluoro-4-(1-pyrrolidinyl)benzyl]-N'-(3-methyl-5-isoquinolinyl)urea
CID 10022547
1-Isoquinolin-5-yl-3-{[4-(pyrrolidin-1-yl)phenyl]methyl}urea
CID 10247042

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-pyridin-3-yl-8,9-dihydro-7H-pyrrolo[3,2-f]quinoline-6-carboxamide?
The IUPAC name of 3-methyl-N-pyridin-3-yl-8,9-dihydro-7H-pyrrolo[3,2-f]quinoline-6-carboxamide (CID 10335309) is 3-methyl-N-pyridin-3-yl-8,9-dihydro-7H-pyrrolo[3,2-f]quinoline-6-carboxamide.
What is the SMILES notation for 3-methyl-N-pyridin-3-yl-8,9-dihydro-7H-pyrrolo[3,2-f]quinoline-6-carboxamide?
The canonical SMILES for 3-methyl-N-pyridin-3-yl-8,9-dihydro-7H-pyrrolo[3,2-f]quinoline-6-carboxamide is Cn1ccc2c3c(ccc21)N(C(=O)Nc1cccnc1)CCC3.
What is the InChIKey of 3-methyl-N-pyridin-3-yl-8,9-dihydro-7H-pyrrolo[3,2-f]quinoline-6-carboxamide?
The InChIKey is POOWHIHRODVUFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N4O/c1-21-11-8-15-14-5-3-10-22(17(14)7-6-16(15)21)18(23)20-13-4-2-9-19-12-13/h2,4,6-9,11-12H,3,5,10H2,1H3,(H,20,23).
What are the key properties of 3-methyl-N-pyridin-3-yl-8,9-dihydro-7H-pyrrolo[3,2-f]quinoline-6-carboxamide?
3-methyl-N-pyridin-3-yl-8,9-dihydro-7H-pyrrolo[3,2-f]quinoline-6-carboxamide has a molecular weight of 306.37 g/mol, XLogP of 3.56, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-pyridin-3-yl-8,9-dihydro-7H-pyrrolo[3,2-f]quinoline-6-carboxamide is sourced from PubChem (CID 10335309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).