1-(methylamino)-3-(4-methylphenoxy)cyclopentane-1-carboxamide

C14H20N2O2 — CID 79648973

IUPAC1-(methylamino)-3-(4-methylphenoxy)cyclopentane-1-carboxamide
SMILESCNC1(C(N)=O)CCC(Oc2ccc(C)cc2)C1
InChIInChI=1S/C14H20N2O2/c1-10-3-5-11(6-4-10)18-12-7-8-14(9-12,16-2)13(15)17/h3-6,12,16H,7-9H2,1-2H3,(H2,15,17)
InChIKeyAVNIHTCLBVKKAS-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.37
Rot. Bonds4

About 1-(methylamino)-3-(4-methylphenoxy)cyclopentane-1-carboxamide

1-(methylamino)-3-(4-methylphenoxy)cyclopentane-1-carboxamide (PubChem CID 79648973) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is 1-(methylamino)-3-(4-methylphenoxy)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-(methylamino)-3-(4-methylphenoxy)cyclopentane-1-carboxamide
PubChem CID79648973
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC Name1-(methylamino)-3-(4-methylphenoxy)cyclopentane-1-carboxamide
SMILESCNC1(C(N)=O)CCC(Oc2ccc(C)cc2)C1
InChIInChI=1S/C14H20N2O2/c1-10-3-5-11(6-4-10)18-12-7-8-14(9-12,16-2)13(15)17/h3-6,12,16H,7-9H2,1-2H3,(H2,15,17)
InChIKeyAVNIHTCLBVKKAS-UHFFFAOYSA-N
XLogP1.37
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(3,5-dimethoxyphenoxy)-1-(methylamino)cyclopentane-1-carboxamide
CID 79646943
1-(methylamino)-3-(3-methyl-4-propan-2-ylphenoxy)cyclopentane-1-carboxamide
CID 79647720
1-(methylamino)-3-(2,3,5-trimethylphenoxy)cyclopentane-1-carboxamide
CID 79649389
3-[3-(hydroxymethyl)phenoxy]-1-(methylamino)cyclopentane-1-carboxamide
CID 79648806
1-(cyclopropylamino)-3-(3,5-dimethylphenoxy)cyclopentane-1-carboxamide
CID 79647749
ethyl 3-[4-(hydroxymethyl)phenoxy]-1-(methylamino)cyclopentane-1-carboxylate
CID 79646696
3-(3,5-dimethylphenoxy)-1-(ethylamino)cyclopentane-1-carboxamide
CID 79648842
3-(3-fluorophenoxy)-1-(methylamino)cyclohexane-1-carboxamide
CID 79637419
1-(methylamino)-3-(2-nitrophenoxy)cyclopentane-1-carboxamide
CID 79649110
3-(3,5-dimethylphenoxy)-1-(propan-2-ylamino)cyclopentane-1-carboxylic acid
CID 79647745
3-(2,3-dihydro-1H-inden-5-yloxy)-1-(methylamino)cyclopentane-1-carboxylic acid
CID 79649371
3-(2-fluoro-4-nitrophenoxy)-1-(methylamino)cyclopentane-1-carboxamide
CID 79646685

Frequently Asked Questions

What is the IUPAC name of 1-(methylamino)-3-(4-methylphenoxy)cyclopentane-1-carboxamide?
The IUPAC name of 1-(methylamino)-3-(4-methylphenoxy)cyclopentane-1-carboxamide (CID 79648973) is 1-(methylamino)-3-(4-methylphenoxy)cyclopentane-1-carboxamide.
What is the SMILES notation for 1-(methylamino)-3-(4-methylphenoxy)cyclopentane-1-carboxamide?
The canonical SMILES for 1-(methylamino)-3-(4-methylphenoxy)cyclopentane-1-carboxamide is CNC1(C(N)=O)CCC(Oc2ccc(C)cc2)C1.
What is the InChIKey of 1-(methylamino)-3-(4-methylphenoxy)cyclopentane-1-carboxamide?
The InChIKey is AVNIHTCLBVKKAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c1-10-3-5-11(6-4-10)18-12-7-8-14(9-12,16-2)13(15)17/h3-6,12,16H,7-9H2,1-2H3,(H2,15,17).
What are the key properties of 1-(methylamino)-3-(4-methylphenoxy)cyclopentane-1-carboxamide?
1-(methylamino)-3-(4-methylphenoxy)cyclopentane-1-carboxamide has a molecular weight of 248.33 g/mol, XLogP of 1.37, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(methylamino)-3-(4-methylphenoxy)cyclopentane-1-carboxamide is sourced from PubChem (CID 79648973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).