2-cyclopropyl-N-[2-(1-methylpyrazol-4-yl)ethyl]quinoline-4-carboxamide

C19H20N4O — CID 51083364

IUPAC2-cyclopropyl-N-[2-(1-methylpyrazol-4-yl)ethyl]quinoline-4-carboxamide
SMILESCn1cc(CCNC(=O)c2cc(C3CC3)nc3ccccc23)cn1
InChIInChI=1S/C19H20N4O/c1-23-12-13(11-21-23)8-9-20-19(24)16-10-18(14-6-7-14)22-17-5-3-2-4-15(16)17/h2-5,10-12,14H,6-9H2,1H3,(H,20,24)
InChIKeyZYXNUGAVABEFJL-UHFFFAOYSA-N
MW320.40 g/mol
LogP2.82
Rot. Bonds5

About 2-cyclopropyl-N-[2-(1-methylpyrazol-4-yl)ethyl]quinoline-4-carboxamide

2-cyclopropyl-N-[2-(1-methylpyrazol-4-yl)ethyl]quinoline-4-carboxamide (PubChem CID 51083364) has the molecular formula C19H20N4O and a molecular weight of 320.40 g/mol. Its IUPAC name is 2-cyclopropyl-N-[2-(1-methylpyrazol-4-yl)ethyl]quinoline-4-carboxamide.

Molecular Properties

Compound Name2-cyclopropyl-N-[2-(1-methylpyrazol-4-yl)ethyl]quinoline-4-carboxamide
PubChem CID51083364
Molecular FormulaC19H20N4O
Molecular Weight320.40 g/mol
Exact Mass320.16
IUPAC Name2-cyclopropyl-N-[2-(1-methylpyrazol-4-yl)ethyl]quinoline-4-carboxamide
SMILESCn1cc(CCNC(=O)c2cc(C3CC3)nc3ccccc23)cn1
InChIInChI=1S/C19H20N4O/c1-23-12-13(11-21-23)8-9-20-19(24)16-10-18(14-6-7-14)22-17-5-3-2-4-15(16)17/h2-5,10-12,14H,6-9H2,1H3,(H,20,24)
InChIKeyZYXNUGAVABEFJL-UHFFFAOYSA-N
XLogP2.82
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.40
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-(1-methylpyrazol-4-yl)propyl]-2-pyridin-4-ylquinoline-4-carboxamide
CID 72837727
2-(1-methylpyrazol-4-yl)-N-[(1-methylpyrazol-4-yl)methyl]quinoline-4-carboxamide
CID 19513012
2-cyclopropyl-N-[3-(2-methylbenzimidazol-1-yl)propyl]quinoline-4-carboxamide
CID 134036923
2-cyclopropyl-N-(pyridin-4-ylmethyl)quinoline-4-carboxamide
CID 42537662
2-(1-methylpyrazol-4-yl)-N-propylquinoline-4-carboxamide
CID 19513031
N-[(1-methylpyrazol-4-yl)methyl]-2-(4-propylphenyl)quinoline-4-carboxamide
CID 1257098
N-[2-(1-methylpyrazol-4-yl)ethyl]-1H-indole-3-carboxamide
CID 47381471
2-cyclopropyl-N-[(3,4,5-trimethoxyphenyl)methyl]quinoline-4-carboxamide
CID 9483435
N-(3-amino-2,2-dimethyl-3-oxopropyl)-2-cyclopropylquinoline-4-carboxamide
CID 60557838
2-cyclopropyl-N-[(3-methoxyphenyl)methyl]quinoline-4-carboxamide
CID 9377696
N-(2-methoxyethyl)-2-(1-methylpyrazol-4-yl)quinoline-4-carboxamide
CID 19518443
2-cyclopropyl-N-[(2R)-2-hydroxy-2-phenylethyl]quinoline-4-carboxamide
CID 42534455

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-N-[2-(1-methylpyrazol-4-yl)ethyl]quinoline-4-carboxamide?
The IUPAC name of 2-cyclopropyl-N-[2-(1-methylpyrazol-4-yl)ethyl]quinoline-4-carboxamide (CID 51083364) is 2-cyclopropyl-N-[2-(1-methylpyrazol-4-yl)ethyl]quinoline-4-carboxamide.
What is the SMILES notation for 2-cyclopropyl-N-[2-(1-methylpyrazol-4-yl)ethyl]quinoline-4-carboxamide?
The canonical SMILES for 2-cyclopropyl-N-[2-(1-methylpyrazol-4-yl)ethyl]quinoline-4-carboxamide is Cn1cc(CCNC(=O)c2cc(C3CC3)nc3ccccc23)cn1.
What is the InChIKey of 2-cyclopropyl-N-[2-(1-methylpyrazol-4-yl)ethyl]quinoline-4-carboxamide?
The InChIKey is ZYXNUGAVABEFJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O/c1-23-12-13(11-21-23)8-9-20-19(24)16-10-18(14-6-7-14)22-17-5-3-2-4-15(16)17/h2-5,10-12,14H,6-9H2,1H3,(H,20,24).
What are the key properties of 2-cyclopropyl-N-[2-(1-methylpyrazol-4-yl)ethyl]quinoline-4-carboxamide?
2-cyclopropyl-N-[2-(1-methylpyrazol-4-yl)ethyl]quinoline-4-carboxamide has a molecular weight of 320.40 g/mol, XLogP of 2.82, 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-(1-methylpyrazol-4-yl)ethyl]quinoline-4-carboxamide is sourced from PubChem (CID 51083364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).