1-[(2-oxo-1H-quinolin-3-yl)methyl]-2-phenylcyclopropane-1-carboxamide

C20H18N2O2 — CID 140567613

IUPAC1-[(2-oxo-1H-quinolin-3-yl)methyl]-2-phenylcyclopropane-1-carboxamide
SMILESNC(=O)C1(Cc2cc3ccccc3[nH]c2=O)CC1c1ccccc1
InChIInChI=1S/C20H18N2O2/c21-19(24)20(12-16(20)13-6-2-1-3-7-13)11-15-10-14-8-4-5-9-17(14)22-18(15)23/h1-10,16H,11-12H2,(H2,21,24)(H,22,23)
InChIKeyBBTMZHGSTGNZPW-UHFFFAOYSA-N
MW318.38 g/mol
LogP2.73
Rot. Bonds4

About 1-[(2-oxo-1H-quinolin-3-yl)methyl]-2-phenylcyclopropane-1-carboxamide

1-[(2-oxo-1H-quinolin-3-yl)methyl]-2-phenylcyclopropane-1-carboxamide (PubChem CID 140567613) has the molecular formula C20H18N2O2 and a molecular weight of 318.38 g/mol. Its IUPAC name is 1-[(2-oxo-1H-quinolin-3-yl)methyl]-2-phenylcyclopropane-1-carboxamide.

Molecular Properties

Compound Name1-[(2-oxo-1H-quinolin-3-yl)methyl]-2-phenylcyclopropane-1-carboxamide
PubChem CID140567613
Molecular FormulaC20H18N2O2
Molecular Weight318.38 g/mol
Exact Mass318.14
IUPAC Name1-[(2-oxo-1H-quinolin-3-yl)methyl]-2-phenylcyclopropane-1-carboxamide
SMILESNC(=O)C1(Cc2cc3ccccc3[nH]c2=O)CC1c1ccccc1
InChIInChI=1S/C20H18N2O2/c21-19(24)20(12-16(20)13-6-2-1-3-7-13)11-15-10-14-8-4-5-9-17(14)22-18(15)23/h1-10,16H,11-12H2,(H2,21,24)(H,22,23)
InChIKeyBBTMZHGSTGNZPW-UHFFFAOYSA-N
XLogP2.73
TPSA75.95 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.38
LogP ≤ 52.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[(2-oxo-1H-quinolin-3-yl)methyl]-2-phenylcyclopropane-1-carboxamide?
The IUPAC name of 1-[(2-oxo-1H-quinolin-3-yl)methyl]-2-phenylcyclopropane-1-carboxamide (CID 140567613) is 1-[(2-oxo-1H-quinolin-3-yl)methyl]-2-phenylcyclopropane-1-carboxamide.
What is the SMILES notation for 1-[(2-oxo-1H-quinolin-3-yl)methyl]-2-phenylcyclopropane-1-carboxamide?
The canonical SMILES for 1-[(2-oxo-1H-quinolin-3-yl)methyl]-2-phenylcyclopropane-1-carboxamide is NC(=O)C1(Cc2cc3ccccc3[nH]c2=O)CC1c1ccccc1.
What is the InChIKey of 1-[(2-oxo-1H-quinolin-3-yl)methyl]-2-phenylcyclopropane-1-carboxamide?
The InChIKey is BBTMZHGSTGNZPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N2O2/c21-19(24)20(12-16(20)13-6-2-1-3-7-13)11-15-10-14-8-4-5-9-17(14)22-18(15)23/h1-10,16H,11-12H2,(H2,21,24)(H,22,23).
What are the key properties of 1-[(2-oxo-1H-quinolin-3-yl)methyl]-2-phenylcyclopropane-1-carboxamide?
1-[(2-oxo-1H-quinolin-3-yl)methyl]-2-phenylcyclopropane-1-carboxamide has a molecular weight of 318.38 g/mol, XLogP of 2.73, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-oxo-1H-quinolin-3-yl)methyl]-2-phenylcyclopropane-1-carboxamide is sourced from PubChem (CID 140567613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).