N-(3-hydroxy-3-naphthalen-1-ylpropyl)cyclopropanecarboxamide

C17H19NO2 — CID 71787907

IUPACN-(3-hydroxy-3-naphthalen-1-ylpropyl)cyclopropanecarboxamide
SMILESO=C(NCCC(O)c1cccc2ccccc12)C1CC1
InChIInChI=1S/C17H19NO2/c19-16(10-11-18-17(20)13-8-9-13)15-7-3-5-12-4-1-2-6-14(12)15/h1-7,13,16,19H,8-11H2,(H,18,20)
InChIKeyDHKOICPHWODZNF-UHFFFAOYSA-N
MW269.34 g/mol
LogP2.79
Rot. Bonds5

About N-(3-hydroxy-3-naphthalen-1-ylpropyl)cyclopropanecarboxamide

N-(3-hydroxy-3-naphthalen-1-ylpropyl)cyclopropanecarboxamide (PubChem CID 71787907) has the molecular formula C17H19NO2 and a molecular weight of 269.34 g/mol. Its IUPAC name is N-(3-hydroxy-3-naphthalen-1-ylpropyl)cyclopropanecarboxamide.

Molecular Properties

Compound NameN-(3-hydroxy-3-naphthalen-1-ylpropyl)cyclopropanecarboxamide
PubChem CID71787907
Molecular FormulaC17H19NO2
Molecular Weight269.34 g/mol
Exact Mass269.14
IUPAC NameN-(3-hydroxy-3-naphthalen-1-ylpropyl)cyclopropanecarboxamide
SMILESO=C(NCCC(O)c1cccc2ccccc12)C1CC1
InChIInChI=1S/C17H19NO2/c19-16(10-11-18-17(20)13-8-9-13)15-7-3-5-12-4-1-2-6-14(12)15/h1-7,13,16,19H,8-11H2,(H,18,20)
InChIKeyDHKOICPHWODZNF-UHFFFAOYSA-N
XLogP2.79
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.34
LogP ≤ 52.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-hydroxy-3-naphthalen-1-ylpropyl)-1-methylsulfonylpiperidine-4-carboxamide
CID 90524448
N-[(2R)-2-hydroxy-2-naphthalen-1-ylethyl]cyclopentanecarboxamide
CID 95367123
N-(3-hydroxy-3-naphthalen-1-ylpropyl)-2-methylpropanamide
CID 90524323
N-(3-hydroxy-3-naphthalen-1-ylpropyl)butanamide
CID 90524322
N-(3-hydroxy-3-naphthalen-1-ylpropyl)adamantane-1-carboxamide
CID 90524399
N-(3-hydroxy-3-naphthalen-1-ylpropyl)-2,2-diphenylacetamide
CID 90524453
1-(3-hydroxy-3-naphthalen-1-ylpropyl)-3-(2-phenylethyl)urea
CID 90524671
N-(3-hydroxy-3-naphthalen-1-ylpropyl)-2-methoxyacetamide
CID 71787908
N-(3-hydroxy-3-phenylpropyl)-4-methylcyclohexane-1-carboxamide
CID 111471611
N-(3-hydroxy-3-naphthalen-1-ylpropyl)thiophene-2-carboxamide
CID 90524337
N-(3-hydroxy-3-naphthalen-1-ylpropyl)-N'-(4-methylphenyl)oxamide
CID 90524589
3-(benzenesulfonyl)-N-(3-hydroxy-3-naphthalen-1-ylpropyl)propanamide
CID 90524456

Frequently Asked Questions

What is the IUPAC name of N-(3-hydroxy-3-naphthalen-1-ylpropyl)cyclopropanecarboxamide?
The IUPAC name of N-(3-hydroxy-3-naphthalen-1-ylpropyl)cyclopropanecarboxamide (CID 71787907) is N-(3-hydroxy-3-naphthalen-1-ylpropyl)cyclopropanecarboxamide.
What is the SMILES notation for N-(3-hydroxy-3-naphthalen-1-ylpropyl)cyclopropanecarboxamide?
The canonical SMILES for N-(3-hydroxy-3-naphthalen-1-ylpropyl)cyclopropanecarboxamide is O=C(NCCC(O)c1cccc2ccccc12)C1CC1.
What is the InChIKey of N-(3-hydroxy-3-naphthalen-1-ylpropyl)cyclopropanecarboxamide?
The InChIKey is DHKOICPHWODZNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO2/c19-16(10-11-18-17(20)13-8-9-13)15-7-3-5-12-4-1-2-6-14(12)15/h1-7,13,16,19H,8-11H2,(H,18,20).
What are the key properties of N-(3-hydroxy-3-naphthalen-1-ylpropyl)cyclopropanecarboxamide?
N-(3-hydroxy-3-naphthalen-1-ylpropyl)cyclopropanecarboxamide has a molecular weight of 269.34 g/mol, XLogP of 2.79, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-hydroxy-3-naphthalen-1-ylpropyl)cyclopropanecarboxamide is sourced from PubChem (CID 71787907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).