(1R)-N-naphthalen-1-yl-2-phenylcyclobutane-1-carboxamide

C21H19NO — CID 146488931

IUPAC(1R)-N-naphthalen-1-yl-2-phenylcyclobutane-1-carboxamide
SMILESO=C(Nc1cccc2ccccc12)[C@@H]1CCC1c1ccccc1
InChIInChI=1S/C21H19NO/c23-21(19-14-13-17(19)15-7-2-1-3-8-15)22-20-12-6-10-16-9-4-5-11-18(16)20/h1-12,17,19H,13-14H2,(H,22,23)/t17?,19-/m1/s1
InChIKeySTTGXEVDRWPEDQ-WHCXFUJUSA-N
MW301.39 g/mol
LogP4.97
Rot. Bonds3

About (1R)-N-naphthalen-1-yl-2-phenylcyclobutane-1-carboxamide

(1R)-N-naphthalen-1-yl-2-phenylcyclobutane-1-carboxamide (PubChem CID 146488931) has the molecular formula C21H19NO and a molecular weight of 301.39 g/mol. Its IUPAC name is (1R)-N-naphthalen-1-yl-2-phenylcyclobutane-1-carboxamide.

Molecular Properties

Compound Name(1R)-N-naphthalen-1-yl-2-phenylcyclobutane-1-carboxamide
PubChem CID146488931
Molecular FormulaC21H19NO
Molecular Weight301.39 g/mol
Exact Mass301.15
IUPAC Name(1R)-N-naphthalen-1-yl-2-phenylcyclobutane-1-carboxamide
SMILESO=C(Nc1cccc2ccccc12)[C@@H]1CCC1c1ccccc1
InChIInChI=1S/C21H19NO/c23-21(19-14-13-17(19)15-7-2-1-3-8-15)22-20-12-6-10-16-9-4-5-11-18(16)20/h1-12,17,19H,13-14H2,(H,22,23)/t17?,19-/m1/s1
InChIKeySTTGXEVDRWPEDQ-WHCXFUJUSA-N
XLogP4.97
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.39
LogP ≤ 54.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

trans-(1R,2R)-2-(3,5-dichlorophenyl)-N-naphthalen-1-ylcyclopropane-1-carboxamide
CID 96564578
trans-(1R,2R)-2-(naphthalen-1-ylcarbamoyl)cyclohexane-1-carboxylic acid
CID 823443
3-(naphthalen-1-ylcarbamoyl)cyclopentane-1-carboxylic acid
CID 103549777
2-naphthalen-1-yl-2-[(2-phenylcyclobutanecarbonyl)amino]acetic acid
CID 166319656
(1S,5S)-N-naphthalen-1-yl-7-phenylbicyclo[3.1.1]heptane-6-carboxamide
CID 7375079
2-(2-fluorophenyl)-N-naphthalen-1-ylcyclopropane-1-carboxamide
CID 134009901
(2R,3R)-1-methyl-N-naphthalen-1-yl-5-oxo-2-phenylpyrrolidine-3-carboxamide
CID 29130811
(1S,6S)-6-(naphthalen-1-ylcarbamoyl)cyclohex-3-ene-1-carboxylate
CID 6944650
(1R,6S)-6-(naphthalen-1-ylcarbamoyl)cyclohex-3-ene-1-carboxylate
CID 6944652
(3S,4R)-N-isoquinolin-5-yl-4-phenylpyrrolidine-3-carboxamide
CID 156839400
(3S,4R)-N-(7-methylnaphthalen-1-yl)-4-phenylpyrrolidine-3-carboxamide
CID 158761407
N-naphthalen-1-ylpiperidine-4-carboxamide
CID 18073022

Frequently Asked Questions

What is the IUPAC name of (1R)-N-naphthalen-1-yl-2-phenylcyclobutane-1-carboxamide?
The IUPAC name of (1R)-N-naphthalen-1-yl-2-phenylcyclobutane-1-carboxamide (CID 146488931) is (1R)-N-naphthalen-1-yl-2-phenylcyclobutane-1-carboxamide.
What is the SMILES notation for (1R)-N-naphthalen-1-yl-2-phenylcyclobutane-1-carboxamide?
The canonical SMILES for (1R)-N-naphthalen-1-yl-2-phenylcyclobutane-1-carboxamide is O=C(Nc1cccc2ccccc12)[C@@H]1CCC1c1ccccc1.
What is the InChIKey of (1R)-N-naphthalen-1-yl-2-phenylcyclobutane-1-carboxamide?
The InChIKey is STTGXEVDRWPEDQ-WHCXFUJUSA-N. The full InChI is InChI=1S/C21H19NO/c23-21(19-14-13-17(19)15-7-2-1-3-8-15)22-20-12-6-10-16-9-4-5-11-18(16)20/h1-12,17,19H,13-14H2,(H,22,23)/t17?,19-/m1/s1.
What are the key properties of (1R)-N-naphthalen-1-yl-2-phenylcyclobutane-1-carboxamide?
(1R)-N-naphthalen-1-yl-2-phenylcyclobutane-1-carboxamide has a molecular weight of 301.39 g/mol, XLogP of 4.97, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-N-naphthalen-1-yl-2-phenylcyclobutane-1-carboxamide is sourced from PubChem (CID 146488931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).