2-amino-N-[2-(3-methylphenoxy)ethyl]cyclopentane-1-carboxamide

C15H22N2O2 — CID 64824425

IUPAC2-amino-N-[2-(3-methylphenoxy)ethyl]cyclopentane-1-carboxamide
SMILESCc1cccc(OCCNC(=O)C2CCCC2N)c1
InChIInChI=1S/C15H22N2O2/c1-11-4-2-5-12(10-11)19-9-8-17-15(18)13-6-3-7-14(13)16/h2,4-5,10,13-14H,3,6-9,16H2,1H3,(H,17,18)
InChIKeyNDDJZNBVAXYCJI-UHFFFAOYSA-N
MW262.35 g/mol
LogP1.62
Rot. Bonds5

About 2-amino-N-[2-(3-methylphenoxy)ethyl]cyclopentane-1-carboxamide

2-amino-N-[2-(3-methylphenoxy)ethyl]cyclopentane-1-carboxamide (PubChem CID 64824425) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is 2-amino-N-[2-(3-methylphenoxy)ethyl]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name2-amino-N-[2-(3-methylphenoxy)ethyl]cyclopentane-1-carboxamide
PubChem CID64824425
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name2-amino-N-[2-(3-methylphenoxy)ethyl]cyclopentane-1-carboxamide
SMILESCc1cccc(OCCNC(=O)C2CCCC2N)c1
InChIInChI=1S/C15H22N2O2/c1-11-4-2-5-12(10-11)19-9-8-17-15(18)13-6-3-7-14(13)16/h2,4-5,10,13-14H,3,6-9,16H2,1H3,(H,17,18)
InChIKeyNDDJZNBVAXYCJI-UHFFFAOYSA-N
XLogP1.62
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 51.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

cis-(1R,2S)-2-amino-N-(2-phenoxyethyl)cyclohexane-1-carboxamide
CID 69204145
1-cycloheptyl-3-[2-(3-methylphenoxy)ethyl]urea
CID 38159345
(2R)-N-[2-(3-methylphenoxy)ethyl]-5-oxopyrrolidine-2-carboxamide
CID 95159054
2-amino-N-[3-(2-methoxyethoxy)phenyl]cyclopentane-1-carboxamide;hydrochloride
CID 119723449
2-amino-N-(3-propoxyphenyl)cyclohexane-1-carboxamide
CID 64822364
N-[4-[3-(3-methylphenoxy)propylamino]-4-oxobutyl]cyclopropanecarboxamide
CID 46438274
1-(4-methylbenzoyl)-N-[2-(3-methylphenoxy)ethyl]piperidine-3-carboxamide
CID 46422462
N-[2-(3-methylphenoxy)ethyl]cyclopentanamine
CID 54798962
2-methyl-N-[2-(3-methylphenoxy)ethyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide
CID 43041216
4-cyclopentyloxy-3-methoxy-N-[2-(3-methylphenoxy)ethyl]benzamide
CID 55792742
N-[2-(3-aminophenoxy)ethyl]-2,2-dimethylcyclopentane-1-carboxamide
CID 107174861
N-[[2-(bromomethyl)cyclopentyl]methyl]-3-(3-methylphenoxy)propanamide
CID 114317193

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-(3-methylphenoxy)ethyl]cyclopentane-1-carboxamide?
The IUPAC name of 2-amino-N-[2-(3-methylphenoxy)ethyl]cyclopentane-1-carboxamide (CID 64824425) is 2-amino-N-[2-(3-methylphenoxy)ethyl]cyclopentane-1-carboxamide.
What is the SMILES notation for 2-amino-N-[2-(3-methylphenoxy)ethyl]cyclopentane-1-carboxamide?
The canonical SMILES for 2-amino-N-[2-(3-methylphenoxy)ethyl]cyclopentane-1-carboxamide is Cc1cccc(OCCNC(=O)C2CCCC2N)c1.
What is the InChIKey of 2-amino-N-[2-(3-methylphenoxy)ethyl]cyclopentane-1-carboxamide?
The InChIKey is NDDJZNBVAXYCJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-11-4-2-5-12(10-11)19-9-8-17-15(18)13-6-3-7-14(13)16/h2,4-5,10,13-14H,3,6-9,16H2,1H3,(H,17,18).
What are the key properties of 2-amino-N-[2-(3-methylphenoxy)ethyl]cyclopentane-1-carboxamide?
2-amino-N-[2-(3-methylphenoxy)ethyl]cyclopentane-1-carboxamide has a molecular weight of 262.35 g/mol, XLogP of 1.62, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-(3-methylphenoxy)ethyl]cyclopentane-1-carboxamide is sourced from PubChem (CID 64824425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).