N-[(7-methoxynaphthalen-1-yl)methoxy]cyclopropanecarboxamide

C16H17NO3 — CID 19967333

IUPACN-[(7-methoxynaphthalen-1-yl)methoxy]cyclopropanecarboxamide
SMILESCOc1ccc2cccc(CONC(=O)C3CC3)c2c1
InChIInChI=1S/C16H17NO3/c1-19-14-8-7-11-3-2-4-13(15(11)9-14)10-20-17-16(18)12-5-6-12/h2-4,7-9,12H,5-6,10H2,1H3,(H,17,18)
InChIKeyQSAKTICTURLPQJ-UHFFFAOYSA-N
MW271.32 g/mol
LogP2.81
Rot. Bonds5

About N-[(7-methoxynaphthalen-1-yl)methoxy]cyclopropanecarboxamide

N-[(7-methoxynaphthalen-1-yl)methoxy]cyclopropanecarboxamide (PubChem CID 19967333) has the molecular formula C16H17NO3 and a molecular weight of 271.32 g/mol. Its IUPAC name is N-[(7-methoxynaphthalen-1-yl)methoxy]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[(7-methoxynaphthalen-1-yl)methoxy]cyclopropanecarboxamide
PubChem CID19967333
Molecular FormulaC16H17NO3
Molecular Weight271.32 g/mol
Exact Mass271.12
IUPAC NameN-[(7-methoxynaphthalen-1-yl)methoxy]cyclopropanecarboxamide
SMILESCOc1ccc2cccc(CONC(=O)C3CC3)c2c1
InChIInChI=1S/C16H17NO3/c1-19-14-8-7-11-3-2-4-13(15(11)9-14)10-20-17-16(18)12-5-6-12/h2-4,7-9,12H,5-6,10H2,1H3,(H,17,18)
InChIKeyQSAKTICTURLPQJ-UHFFFAOYSA-N
XLogP2.81
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-[3-(7-methoxynaphthalen-1-yl)propyl]cyclopentanecarboxamide
CID 19086062
cis-(1R,3S)-3-[[2-(7-methoxynaphthalen-1-yl)acetyl]amino]cyclopentane-1-carboxylic acid
CID 120678697
1-cyclopropyl-3-(7-methoxynaphthalen-1-yl)propan-2-one
CID 113325067
N-[2-(7-methoxynaphthalen-1-yl)cyclopropyl]cyclopropanecarboxamide
CID 10221363
N-[3-(7-methoxynaphthalen-1-yl)propyl]cyclopropanecarbothioamide
CID 19086085
2-[[2-(7-methoxynaphthalen-1-yl)acetyl]amino]cyclopentane-1-carboxamide
CID 75388302
2-[cyclopropyl-[2-(7-methoxynaphthalen-1-yl)acetyl]amino]propanoic acid
CID 120519197
3-cyclopropyl-2-[[2-(7-methoxynaphthalen-1-yl)acetyl]amino]propanoic acid
CID 120535790
1-(3-amino-4-methylpyrrolidin-1-yl)-2-(7-methoxynaphthalen-1-yl)ethanone
CID 166238550
1-cyclopropyl-2-(7-methoxynaphthalen-1-yl)ethanamine
CID 115506198
5-(7-methoxynaphthalen-1-yl)pentanamide
CID 67627444
N-[2-(7-methoxynaphthalen-1-yl)ethyl]acetamide
CID 139057200

Frequently Asked Questions

What is the IUPAC name of N-[(7-methoxynaphthalen-1-yl)methoxy]cyclopropanecarboxamide?
The IUPAC name of N-[(7-methoxynaphthalen-1-yl)methoxy]cyclopropanecarboxamide (CID 19967333) is N-[(7-methoxynaphthalen-1-yl)methoxy]cyclopropanecarboxamide.
What is the SMILES notation for N-[(7-methoxynaphthalen-1-yl)methoxy]cyclopropanecarboxamide?
The canonical SMILES for N-[(7-methoxynaphthalen-1-yl)methoxy]cyclopropanecarboxamide is COc1ccc2cccc(CONC(=O)C3CC3)c2c1.
What is the InChIKey of N-[(7-methoxynaphthalen-1-yl)methoxy]cyclopropanecarboxamide?
The InChIKey is QSAKTICTURLPQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO3/c1-19-14-8-7-11-3-2-4-13(15(11)9-14)10-20-17-16(18)12-5-6-12/h2-4,7-9,12H,5-6,10H2,1H3,(H,17,18).
What are the key properties of N-[(7-methoxynaphthalen-1-yl)methoxy]cyclopropanecarboxamide?
N-[(7-methoxynaphthalen-1-yl)methoxy]cyclopropanecarboxamide has a molecular weight of 271.32 g/mol, XLogP of 2.81, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(7-methoxynaphthalen-1-yl)methoxy]cyclopropanecarboxamide is sourced from PubChem (CID 19967333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).