2-cyclopropyl-N-[(2-methoxy-3-pyridinyl)methyl]quinoline-4-carboxamide

C20H19N3O2 — CID 37485659

IUPAC2-cyclopropyl-N-[(2-methoxy-3-pyridinyl)methyl]quinoline-4-carboxamide
SMILESCOc1ncccc1CNC(=O)c1cc(C2CC2)nc2ccccc12
InChIInChI=1S/C20H19N3O2/c1-25-20-14(5-4-10-21-20)12-22-19(24)16-11-18(13-8-9-13)23-17-7-3-2-6-15(16)17/h2-7,10-11,13H,8-9,12H2,1H3,(H,22,24)
InChIKeySGICSPBCHTTZSJ-UHFFFAOYSA-N
MW333.39 g/mol
LogP3.45
Rot. Bonds5

About 2-cyclopropyl-N-[(2-methoxy-3-pyridinyl)methyl]quinoline-4-carboxamide

2-cyclopropyl-N-[(2-methoxy-3-pyridinyl)methyl]quinoline-4-carboxamide (PubChem CID 37485659) has the molecular formula C20H19N3O2 and a molecular weight of 333.39 g/mol. Its IUPAC name is 2-cyclopropyl-N-[(2-methoxy-3-pyridinyl)methyl]quinoline-4-carboxamide.

Molecular Properties

Compound Name2-cyclopropyl-N-[(2-methoxy-3-pyridinyl)methyl]quinoline-4-carboxamide
PubChem CID37485659
Molecular FormulaC20H19N3O2
Molecular Weight333.39 g/mol
Exact Mass333.15
IUPAC Name2-cyclopropyl-N-[(2-methoxy-3-pyridinyl)methyl]quinoline-4-carboxamide
SMILESCOc1ncccc1CNC(=O)c1cc(C2CC2)nc2ccccc12
InChIInChI=1S/C20H19N3O2/c1-25-20-14(5-4-10-21-20)12-22-19(24)16-11-18(13-8-9-13)23-17-7-3-2-6-15(16)17/h2-7,10-11,13H,8-9,12H2,1H3,(H,22,24)
InChIKeySGICSPBCHTTZSJ-UHFFFAOYSA-N
XLogP3.45
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.39
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-cyclopropyl-N-[(2-methoxy-3-pyridinyl)methyl]quinoline-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-cyclopropyl-N-[(3-methoxyphenyl)methyl]quinoline-4-carboxamide
CID 9377696
2-cyclopropyl-N-(pyridin-4-ylmethyl)quinoline-4-carboxamide
CID 42537662
2-cyclopropyl-N-[(3,4,5-trimethoxyphenyl)methyl]quinoline-4-carboxamide
CID 9483435
2-cyclopropyl-N-[(2R)-2-hydroxy-2-phenylethyl]quinoline-4-carboxamide
CID 42534455
2-iodo-N-[(2-methoxy-3-pyridinyl)methyl]benzamide
CID 38533778
2-amino-N-[(2-methoxy-3-pyridinyl)methyl]benzamide
CID 61213958
N-(3-amino-2,2-dimethyl-3-oxopropyl)-2-cyclopropylquinoline-4-carboxamide
CID 60557838
N-[2-[(2-methoxy-3-pyridinyl)methylamino]-2-oxoethyl]-2-phenylacetamide
CID 37486176
N-[(2-hydroxyphenyl)methyl]-2-methoxypyridine-3-carboxamide
CID 115598782
2-cyclopropyl-N-[3-(pyridin-2-ylmethylcarbamoyl)phenyl]quinoline-4-carboxamide
CID 60554928
2-cyclopropyl-N-[(1-phenylcyclopropyl)methyl]quinoline-4-carboxamide
CID 46533084
2-cyclopropyl-N-methylsulfonylquinoline-4-carboxamide
CID 146154924

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-N-[(2-methoxy-3-pyridinyl)methyl]quinoline-4-carboxamide?
The IUPAC name of 2-cyclopropyl-N-[(2-methoxy-3-pyridinyl)methyl]quinoline-4-carboxamide (CID 37485659) is 2-cyclopropyl-N-[(2-methoxy-3-pyridinyl)methyl]quinoline-4-carboxamide.
What is the SMILES notation for 2-cyclopropyl-N-[(2-methoxy-3-pyridinyl)methyl]quinoline-4-carboxamide?
The canonical SMILES for 2-cyclopropyl-N-[(2-methoxy-3-pyridinyl)methyl]quinoline-4-carboxamide is COc1ncccc1CNC(=O)c1cc(C2CC2)nc2ccccc12.
What is the InChIKey of 2-cyclopropyl-N-[(2-methoxy-3-pyridinyl)methyl]quinoline-4-carboxamide?
The InChIKey is SGICSPBCHTTZSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O2/c1-25-20-14(5-4-10-21-20)12-22-19(24)16-11-18(13-8-9-13)23-17-7-3-2-6-15(16)17/h2-7,10-11,13H,8-9,12H2,1H3,(H,22,24).
What are the key properties of 2-cyclopropyl-N-[(2-methoxy-3-pyridinyl)methyl]quinoline-4-carboxamide?
2-cyclopropyl-N-[(2-methoxy-3-pyridinyl)methyl]quinoline-4-carboxamide has a molecular weight of 333.39 g/mol, XLogP of 3.45, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-N-[(2-methoxy-3-pyridinyl)methyl]quinoline-4-carboxamide is sourced from PubChem (CID 37485659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).