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

C16H24N2O3 — CID 66321735

IUPACN-(2-amino-4-methoxyphenyl)-2-(cyclopentylmethoxy)propanamide
SMILESCOc1ccc(NC(=O)C(C)OCC2CCCC2)c(N)c1
InChIInChI=1S/C16H24N2O3/c1-11(21-10-12-5-3-4-6-12)16(19)18-15-8-7-13(20-2)9-14(15)17/h7-9,11-12H,3-6,10,17H2,1-2H3,(H,18,19)
InChIKeyOINCAZOHVZJVPI-UHFFFAOYSA-N
MW292.38 g/mol
LogP2.81
Rot. Bonds6

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

N-(2-amino-4-methoxyphenyl)-2-(cyclopentylmethoxy)propanamide (PubChem CID 66321735) has the molecular formula C16H24N2O3 and a molecular weight of 292.38 g/mol. Its IUPAC name is N-(2-amino-4-methoxyphenyl)-2-(cyclopentylmethoxy)propanamide.

Molecular Properties

Compound NameN-(2-amino-4-methoxyphenyl)-2-(cyclopentylmethoxy)propanamide
PubChem CID66321735
Molecular FormulaC16H24N2O3
Molecular Weight292.38 g/mol
Exact Mass292.18
IUPAC NameN-(2-amino-4-methoxyphenyl)-2-(cyclopentylmethoxy)propanamide
SMILESCOc1ccc(NC(=O)C(C)OCC2CCCC2)c(N)c1
InChIInChI=1S/C16H24N2O3/c1-11(21-10-12-5-3-4-6-12)16(19)18-15-8-7-13(20-2)9-14(15)17/h7-9,11-12H,3-6,10,17H2,1-2H3,(H,18,19)
InChIKeyOINCAZOHVZJVPI-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-methoxyphenyl)-2-(cyclopentylmethoxy)propanamide
CID 66323873
N-(2-amino-4-methoxyphenyl)-2-(2,2-difluoroethoxy)propanamide
CID 82005336
N-(4-amino-2-chlorophenyl)-2-(cyclohexylmethoxy)propanamide
CID 62382552
N-(2-amino-4-methoxyphenyl)-2-cycloheptylacetamide
CID 114457002
N-(2-amino-5-methoxyphenyl)-2-(oxolan-2-ylmethoxy)propanamide
CID 119421308
(2S)-N-(2-amino-4-methoxyphenyl)-2-methylbutanamide
CID 40788880
N-(2-amino-4-methoxyphenyl)-2-[cyclopropylmethyl(ethyl)amino]propanamide
CID 63954097
N-(2-amino-4-methoxyphenyl)cyclobutanecarboxamide
CID 16774141
N-(2-amino-4-methoxyphenyl)-2-(diethylamino)propanamide
CID 16779414
N-(2-amino-4-methoxyphenyl)-2-(2,6-dimethylmorpholin-4-yl)propanamide
CID 16779396
N-(2-amino-5-methoxyphenyl)-2-(3-methylbutoxy)propanamide
CID 119421306
1-(2-amino-4-methoxyphenyl)-3-propylurea
CID 28785607

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-4-methoxyphenyl)-2-(cyclopentylmethoxy)propanamide?
The IUPAC name of N-(2-amino-4-methoxyphenyl)-2-(cyclopentylmethoxy)propanamide (CID 66321735) is N-(2-amino-4-methoxyphenyl)-2-(cyclopentylmethoxy)propanamide.
What is the SMILES notation for N-(2-amino-4-methoxyphenyl)-2-(cyclopentylmethoxy)propanamide?
The canonical SMILES for N-(2-amino-4-methoxyphenyl)-2-(cyclopentylmethoxy)propanamide is COc1ccc(NC(=O)C(C)OCC2CCCC2)c(N)c1.
What is the InChIKey of N-(2-amino-4-methoxyphenyl)-2-(cyclopentylmethoxy)propanamide?
The InChIKey is OINCAZOHVZJVPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3/c1-11(21-10-12-5-3-4-6-12)16(19)18-15-8-7-13(20-2)9-14(15)17/h7-9,11-12H,3-6,10,17H2,1-2H3,(H,18,19).
What are the key properties of N-(2-amino-4-methoxyphenyl)-2-(cyclopentylmethoxy)propanamide?
N-(2-amino-4-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-(2-amino-4-methoxyphenyl)-2-(cyclopentylmethoxy)propanamide is sourced from PubChem (CID 66321735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).