N-[1-(2-methoxyphenyl)cyclopropyl]cyclopentanecarboxamide

C16H21NO2 — CID 110466283

IUPACN-[1-(2-methoxyphenyl)cyclopropyl]cyclopentanecarboxamide
SMILESCOc1ccccc1C1(NC(=O)C2CCCC2)CC1
InChIInChI=1S/C16H21NO2/c1-19-14-9-5-4-8-13(14)16(10-11-16)17-15(18)12-6-2-3-7-12/h4-5,8-9,12H,2-3,6-7,10-11H2,1H3,(H,17,18)
InChIKeyRBIGTPNOLTZDRS-UHFFFAOYSA-N
MW259.35 g/mol
LogP2.99
Rot. Bonds4

About N-[1-(2-methoxyphenyl)cyclopropyl]cyclopentanecarboxamide

N-[1-(2-methoxyphenyl)cyclopropyl]cyclopentanecarboxamide (PubChem CID 110466283) has the molecular formula C16H21NO2 and a molecular weight of 259.35 g/mol. Its IUPAC name is N-[1-(2-methoxyphenyl)cyclopropyl]cyclopentanecarboxamide.

Molecular Properties

Compound NameN-[1-(2-methoxyphenyl)cyclopropyl]cyclopentanecarboxamide
PubChem CID110466283
Molecular FormulaC16H21NO2
Molecular Weight259.35 g/mol
Exact Mass259.16
IUPAC NameN-[1-(2-methoxyphenyl)cyclopropyl]cyclopentanecarboxamide
SMILESCOc1ccccc1C1(NC(=O)C2CCCC2)CC1
InChIInChI=1S/C16H21NO2/c1-19-14-9-5-4-8-13(14)16(10-11-16)17-15(18)12-6-2-3-7-12/h4-5,8-9,12H,2-3,6-7,10-11H2,1H3,(H,17,18)
InChIKeyRBIGTPNOLTZDRS-UHFFFAOYSA-N
XLogP2.99
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.35
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[1-(2-methoxyphenyl)cyclopropyl]cyclopentanecarboxamide?
The IUPAC name of N-[1-(2-methoxyphenyl)cyclopropyl]cyclopentanecarboxamide (CID 110466283) is N-[1-(2-methoxyphenyl)cyclopropyl]cyclopentanecarboxamide.
What is the SMILES notation for N-[1-(2-methoxyphenyl)cyclopropyl]cyclopentanecarboxamide?
The canonical SMILES for N-[1-(2-methoxyphenyl)cyclopropyl]cyclopentanecarboxamide is COc1ccccc1C1(NC(=O)C2CCCC2)CC1.
What is the InChIKey of N-[1-(2-methoxyphenyl)cyclopropyl]cyclopentanecarboxamide?
The InChIKey is RBIGTPNOLTZDRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21NO2/c1-19-14-9-5-4-8-13(14)16(10-11-16)17-15(18)12-6-2-3-7-12/h4-5,8-9,12H,2-3,6-7,10-11H2,1H3,(H,17,18).
What are the key properties of N-[1-(2-methoxyphenyl)cyclopropyl]cyclopentanecarboxamide?
N-[1-(2-methoxyphenyl)cyclopropyl]cyclopentanecarboxamide has a molecular weight of 259.35 g/mol, XLogP of 2.99, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-methoxyphenyl)cyclopropyl]cyclopentanecarboxamide is sourced from PubChem (CID 110466283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).