N-methyl-N-[(2R)-4-oxo-2,3-dihydro-1H-naphthalen-2-yl]cyclopropanecarboxamide

C15H17NO2 — CID 125471376

IUPACN-methyl-N-[(2R)-4-oxo-2,3-dihydro-1H-naphthalen-2-yl]cyclopropanecarboxamide
SMILESCN(C(=O)C1CC1)[C@H]1CC(=O)c2ccccc2C1
InChIInChI=1S/C15H17NO2/c1-16(15(18)10-6-7-10)12-8-11-4-2-3-5-13(11)14(17)9-12/h2-5,10,12H,6-9H2,1H3/t12-/m1/s1
InChIKeyPITJUVHXHVTDQO-GFCCVEGCSA-N
MW243.31 g/mol
LogP2.05
Rot. Bonds2

About N-methyl-N-[(2R)-4-oxo-2,3-dihydro-1H-naphthalen-2-yl]cyclopropanecarboxamide

N-methyl-N-[(2R)-4-oxo-2,3-dihydro-1H-naphthalen-2-yl]cyclopropanecarboxamide (PubChem CID 125471376) has the molecular formula C15H17NO2 and a molecular weight of 243.31 g/mol. Its IUPAC name is N-methyl-N-[(2R)-4-oxo-2,3-dihydro-1H-naphthalen-2-yl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-methyl-N-[(2R)-4-oxo-2,3-dihydro-1H-naphthalen-2-yl]cyclopropanecarboxamide
PubChem CID125471376
Molecular FormulaC15H17NO2
Molecular Weight243.31 g/mol
Exact Mass243.13
IUPAC NameN-methyl-N-[(2R)-4-oxo-2,3-dihydro-1H-naphthalen-2-yl]cyclopropanecarboxamide
SMILESCN(C(=O)C1CC1)[C@H]1CC(=O)c2ccccc2C1
InChIInChI=1S/C15H17NO2/c1-16(15(18)10-6-7-10)12-8-11-4-2-3-5-13(11)14(17)9-12/h2-5,10,12H,6-9H2,1H3/t12-/m1/s1
InChIKeyPITJUVHXHVTDQO-GFCCVEGCSA-N
XLogP2.05
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 52.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(2R)-4-oxo-2,3-dihydro-1H-naphthalen-2-yl]cyclopropanecarboxamide?
The IUPAC name of N-methyl-N-[(2R)-4-oxo-2,3-dihydro-1H-naphthalen-2-yl]cyclopropanecarboxamide (CID 125471376) is N-methyl-N-[(2R)-4-oxo-2,3-dihydro-1H-naphthalen-2-yl]cyclopropanecarboxamide.
What is the SMILES notation for N-methyl-N-[(2R)-4-oxo-2,3-dihydro-1H-naphthalen-2-yl]cyclopropanecarboxamide?
The canonical SMILES for N-methyl-N-[(2R)-4-oxo-2,3-dihydro-1H-naphthalen-2-yl]cyclopropanecarboxamide is CN(C(=O)C1CC1)[C@H]1CC(=O)c2ccccc2C1.
What is the InChIKey of N-methyl-N-[(2R)-4-oxo-2,3-dihydro-1H-naphthalen-2-yl]cyclopropanecarboxamide?
The InChIKey is PITJUVHXHVTDQO-GFCCVEGCSA-N. The full InChI is InChI=1S/C15H17NO2/c1-16(15(18)10-6-7-10)12-8-11-4-2-3-5-13(11)14(17)9-12/h2-5,10,12H,6-9H2,1H3/t12-/m1/s1.
What are the key properties of N-methyl-N-[(2R)-4-oxo-2,3-dihydro-1H-naphthalen-2-yl]cyclopropanecarboxamide?
N-methyl-N-[(2R)-4-oxo-2,3-dihydro-1H-naphthalen-2-yl]cyclopropanecarboxamide has a molecular weight of 243.31 g/mol, XLogP of 2.05, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(2R)-4-oxo-2,3-dihydro-1H-naphthalen-2-yl]cyclopropanecarboxamide is sourced from PubChem (CID 125471376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).