N-(4-amino-2-methoxyphenyl)-2-(cyclopentylmethoxy)propanamide

C16H24N2O3 — CID 66323873

IUPACN-(4-amino-2-methoxyphenyl)-2-(cyclopentylmethoxy)propanamide
SMILESCOc1cc(N)ccc1NC(=O)C(C)OCC1CCCC1
InChIInChI=1S/C16H24N2O3/c1-11(21-10-12-5-3-4-6-12)16(19)18-14-8-7-13(17)9-15(14)20-2/h7-9,11-12H,3-6,10,17H2,1-2H3,(H,18,19)
InChIKeyCNKBOWXCFFUJSK-UHFFFAOYSA-N
MW292.38 g/mol
LogP2.81
Rot. Bonds6

About N-(4-amino-2-methoxyphenyl)-2-(cyclopentylmethoxy)propanamide

N-(4-amino-2-methoxyphenyl)-2-(cyclopentylmethoxy)propanamide (PubChem CID 66323873) has the molecular formula C16H24N2O3 and a molecular weight of 292.38 g/mol. Its IUPAC name is N-(4-amino-2-methoxyphenyl)-2-(cyclopentylmethoxy)propanamide.

Molecular Properties

Compound NameN-(4-amino-2-methoxyphenyl)-2-(cyclopentylmethoxy)propanamide
PubChem CID66323873
Molecular FormulaC16H24N2O3
Molecular Weight292.38 g/mol
Exact Mass292.18
IUPAC NameN-(4-amino-2-methoxyphenyl)-2-(cyclopentylmethoxy)propanamide
SMILESCOc1cc(N)ccc1NC(=O)C(C)OCC1CCCC1
InChIInChI=1S/C16H24N2O3/c1-11(21-10-12-5-3-4-6-12)16(19)18-14-8-7-13(17)9-15(14)20-2/h7-9,11-12H,3-6,10,17H2,1-2H3,(H,18,19)
InChIKeyCNKBOWXCFFUJSK-UHFFFAOYSA-N
XLogP2.81
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 52.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(4-amino-2-chlorophenyl)-2-(cyclohexylmethoxy)propanamide
CID 62382552
N-(2-amino-4-methoxyphenyl)-2-(cyclopentylmethoxy)propanamide
CID 66321735
N-(4-amino-2-methoxyphenyl)-2-(2-methylpentoxy)propanamide
CID 103282970
N-(4-amino-2-methoxyphenyl)-2-(4-methoxyphenoxy)propanamide
CID 54852607
N-(5-amino-2-methoxyphenyl)-2-ethoxypropanamide
CID 16783991
N-(4-amino-2-methoxyphenyl)-2-[cyclopropyl(methyl)amino]propanamide
CID 43264583
2-(cyclopropylmethoxy)-N-[2-(difluoromethoxy)phenyl]propanamide
CID 86846916
N-(4-amino-2-methoxyphenyl)-2-(1,1,1-trifluoropropan-2-yloxy)propanamide
CID 66275206
2-(cyclopropylmethoxy)-N-[2-(propan-2-ylcarbamoylamino)phenyl]propanamide
CID 48530161
N-(4-amino-2-methoxyphenyl)-2-(4-propan-2-ylphenoxy)propanamide
CID 54852451
N-(4-amino-2-methoxyphenyl)-2-(4-tert-butylphenoxy)propanamide
CID 54852668
N-(4-amino-2-methoxyphenyl)-2-(3,4-dimethylpyrrolidin-1-yl)propanamide
CID 79177188

Frequently Asked Questions

What is the IUPAC name of N-(4-amino-2-methoxyphenyl)-2-(cyclopentylmethoxy)propanamide?
The IUPAC name of N-(4-amino-2-methoxyphenyl)-2-(cyclopentylmethoxy)propanamide (CID 66323873) is N-(4-amino-2-methoxyphenyl)-2-(cyclopentylmethoxy)propanamide.
What is the SMILES notation for N-(4-amino-2-methoxyphenyl)-2-(cyclopentylmethoxy)propanamide?
The canonical SMILES for N-(4-amino-2-methoxyphenyl)-2-(cyclopentylmethoxy)propanamide is COc1cc(N)ccc1NC(=O)C(C)OCC1CCCC1.
What is the InChIKey of N-(4-amino-2-methoxyphenyl)-2-(cyclopentylmethoxy)propanamide?
The InChIKey is CNKBOWXCFFUJSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3/c1-11(21-10-12-5-3-4-6-12)16(19)18-14-8-7-13(17)9-15(14)20-2/h7-9,11-12H,3-6,10,17H2,1-2H3,(H,18,19).
What are the key properties of N-(4-amino-2-methoxyphenyl)-2-(cyclopentylmethoxy)propanamide?
N-(4-amino-2-methoxyphenyl)-2-(cyclopentylmethoxy)propanamide has a molecular weight of 292.38 g/mol, XLogP of 2.81, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-amino-2-methoxyphenyl)-2-(cyclopentylmethoxy)propanamide is sourced from PubChem (CID 66323873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).