4-amino-N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylcyclopent-2-ene-1-carboxamide

C17H24N2O2 — CID 79208827

IUPAC4-amino-N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylcyclopent-2-ene-1-carboxamide
SMILESCOc1ccccc1CC(C)N(C)C(=O)C1C=CC(N)C1
InChIInChI=1S/C17H24N2O2/c1-12(10-13-6-4-5-7-16(13)21-3)19(2)17(20)14-8-9-15(18)11-14/h4-9,12,14-15H,10-11,18H2,1-3H3
InChIKeyLDBPVRZBFLHFRM-UHFFFAOYSA-N
MW288.39 g/mol
LogP1.99
Rot. Bonds5

About 4-amino-N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylcyclopent-2-ene-1-carboxamide

4-amino-N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylcyclopent-2-ene-1-carboxamide (PubChem CID 79208827) has the molecular formula C17H24N2O2 and a molecular weight of 288.39 g/mol. Its IUPAC name is 4-amino-N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylcyclopent-2-ene-1-carboxamide.

Molecular Properties

Compound Name4-amino-N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylcyclopent-2-ene-1-carboxamide
PubChem CID79208827
Molecular FormulaC17H24N2O2
Molecular Weight288.39 g/mol
Exact Mass288.18
IUPAC Name4-amino-N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylcyclopent-2-ene-1-carboxamide
SMILESCOc1ccccc1CC(C)N(C)C(=O)C1C=CC(N)C1
InChIInChI=1S/C17H24N2O2/c1-12(10-13-6-4-5-7-16(13)21-3)19(2)17(20)14-8-9-15(18)11-14/h4-9,12,14-15H,10-11,18H2,1-3H3
InChIKeyLDBPVRZBFLHFRM-UHFFFAOYSA-N
XLogP1.99
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3-amino-N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylcyclohexane-1-carboxamide;hydrochloride
CID 119775947
2-amino-N-[1-(2-methoxyphenyl)propan-2-yl]-N,2-dimethylpentanamide
CID 65487447
2-amino-N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylacetamide;hydrochloride
CID 119319100
2-amino-N-[1-(2-methoxyphenyl)propan-2-yl]-N,4-dimethylpentanamide
CID 65488585
N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylpiperazine-2-carboxamide
CID 65486341
2-[1-(2-methoxyphenyl)propan-2-yl-methylamino]propanehydrazide
CID 65486572
2-methoxy-N-[1-(2-methoxyphenyl)propan-2-yl]-N,2-dimethylpropanamide
CID 103029189
methyl 2-[1-(2-methoxyphenyl)propan-2-yl-methylamino]-2-oxoacetate
CID 112617368
3-ethyl-1-[1-(2-methoxyphenyl)propan-2-yl]-1-methylurea
CID 71994436
N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylpiperidine-3-carboxamide
CID 65487251
2-chloro-N-[1-(2-methoxyphenyl)propan-2-yl-methylcarbamoyl]propanamide
CID 65488311
N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylpyrrolidine-1-carboxamide
CID 115665268

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylcyclopent-2-ene-1-carboxamide?
The IUPAC name of 4-amino-N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylcyclopent-2-ene-1-carboxamide (CID 79208827) is 4-amino-N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylcyclopent-2-ene-1-carboxamide.
What is the SMILES notation for 4-amino-N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylcyclopent-2-ene-1-carboxamide?
The canonical SMILES for 4-amino-N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylcyclopent-2-ene-1-carboxamide is COc1ccccc1CC(C)N(C)C(=O)C1C=CC(N)C1.
What is the InChIKey of 4-amino-N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylcyclopent-2-ene-1-carboxamide?
The InChIKey is LDBPVRZBFLHFRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O2/c1-12(10-13-6-4-5-7-16(13)21-3)19(2)17(20)14-8-9-15(18)11-14/h4-9,12,14-15H,10-11,18H2,1-3H3.
What are the key properties of 4-amino-N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylcyclopent-2-ene-1-carboxamide?
4-amino-N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylcyclopent-2-ene-1-carboxamide has a molecular weight of 288.39 g/mol, XLogP of 1.99, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylcyclopent-2-ene-1-carboxamide is sourced from PubChem (CID 79208827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).