6-[1-(6-methyl-3-pyridinyl)cyclopropyl]quinoline-4-carboxamide

C19H17N3O — CID 175960441

IUPAC6-[1-(6-methyl-3-pyridinyl)cyclopropyl]quinoline-4-carboxamide
SMILESCc1ccc(C2(c3ccc4nccc(C(N)=O)c4c3)CC2)cn1
InChIInChI=1S/C19H17N3O/c1-12-2-3-14(11-22-12)19(7-8-19)13-4-5-17-16(10-13)15(18(20)23)6-9-21-17/h2-6,9-11H,7-8H2,1H3,(H2,20,23)
InChIKeyDRPGFLYAEWJNGH-UHFFFAOYSA-N
MW303.37 g/mol
LogP3.12
Rot. Bonds3

About 6-[1-(6-methyl-3-pyridinyl)cyclopropyl]quinoline-4-carboxamide

6-[1-(6-methyl-3-pyridinyl)cyclopropyl]quinoline-4-carboxamide (PubChem CID 175960441) has the molecular formula C19H17N3O and a molecular weight of 303.37 g/mol. Its IUPAC name is 6-[1-(6-methyl-3-pyridinyl)cyclopropyl]quinoline-4-carboxamide.

Molecular Properties

Compound Name6-[1-(6-methyl-3-pyridinyl)cyclopropyl]quinoline-4-carboxamide
PubChem CID175960441
Molecular FormulaC19H17N3O
Molecular Weight303.37 g/mol
Exact Mass303.14
IUPAC Name6-[1-(6-methyl-3-pyridinyl)cyclopropyl]quinoline-4-carboxamide
SMILESCc1ccc(C2(c3ccc4nccc(C(N)=O)c4c3)CC2)cn1
InChIInChI=1S/C19H17N3O/c1-12-2-3-14(11-22-12)19(7-8-19)13-4-5-17-16(10-13)15(18(20)23)6-9-21-17/h2-6,9-11H,7-8H2,1H3,(H2,20,23)
InChIKeyDRPGFLYAEWJNGH-UHFFFAOYSA-N
XLogP3.12
TPSA68.87 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.37
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-[1-(6-methyl-3-pyridinyl)cyclopropyl]quinoline-4-carboxamide?
The IUPAC name of 6-[1-(6-methyl-3-pyridinyl)cyclopropyl]quinoline-4-carboxamide (CID 175960441) is 6-[1-(6-methyl-3-pyridinyl)cyclopropyl]quinoline-4-carboxamide.
What is the SMILES notation for 6-[1-(6-methyl-3-pyridinyl)cyclopropyl]quinoline-4-carboxamide?
The canonical SMILES for 6-[1-(6-methyl-3-pyridinyl)cyclopropyl]quinoline-4-carboxamide is Cc1ccc(C2(c3ccc4nccc(C(N)=O)c4c3)CC2)cn1.
What is the InChIKey of 6-[1-(6-methyl-3-pyridinyl)cyclopropyl]quinoline-4-carboxamide?
The InChIKey is DRPGFLYAEWJNGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N3O/c1-12-2-3-14(11-22-12)19(7-8-19)13-4-5-17-16(10-13)15(18(20)23)6-9-21-17/h2-6,9-11H,7-8H2,1H3,(H2,20,23).
What are the key properties of 6-[1-(6-methyl-3-pyridinyl)cyclopropyl]quinoline-4-carboxamide?
6-[1-(6-methyl-3-pyridinyl)cyclopropyl]quinoline-4-carboxamide has a molecular weight of 303.37 g/mol, XLogP of 3.12, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[1-(6-methyl-3-pyridinyl)cyclopropyl]quinoline-4-carboxamide is sourced from PubChem (CID 175960441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).