N-(2-aminophenyl)-2,5-dimethyl-N-propylfuran-3-carboxamide

C16H20N2O2 — CID 63230482

IUPACN-(2-aminophenyl)-2,5-dimethyl-N-propylfuran-3-carboxamide
SMILESCCCN(C(=O)c1cc(C)oc1C)c1ccccc1N
InChIInChI=1S/C16H20N2O2/c1-4-9-18(15-8-6-5-7-14(15)17)16(19)13-10-11(2)20-12(13)3/h5-8,10H,4,9,17H2,1-3H3
InChIKeyHXJADPMCEMVQRG-UHFFFAOYSA-N
MW272.35 g/mol
LogP3.54
Rot. Bonds4

About N-(2-aminophenyl)-2,5-dimethyl-N-propylfuran-3-carboxamide

N-(2-aminophenyl)-2,5-dimethyl-N-propylfuran-3-carboxamide (PubChem CID 63230482) has the molecular formula C16H20N2O2 and a molecular weight of 272.35 g/mol. Its IUPAC name is N-(2-aminophenyl)-2,5-dimethyl-N-propylfuran-3-carboxamide.

Molecular Properties

Compound NameN-(2-aminophenyl)-2,5-dimethyl-N-propylfuran-3-carboxamide
PubChem CID63230482
Molecular FormulaC16H20N2O2
Molecular Weight272.35 g/mol
Exact Mass272.15
IUPAC NameN-(2-aminophenyl)-2,5-dimethyl-N-propylfuran-3-carboxamide
SMILESCCCN(C(=O)c1cc(C)oc1C)c1ccccc1N
InChIInChI=1S/C16H20N2O2/c1-4-9-18(15-8-6-5-7-14(15)17)16(19)13-10-11(2)20-12(13)3/h5-8,10H,4,9,17H2,1-3H3
InChIKeyHXJADPMCEMVQRG-UHFFFAOYSA-N
XLogP3.54
TPSA59.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(2-aminophenyl)-5-fluoro-2-methyl-N-propylbenzamide
CID 63230448
N-(2-aminophenyl)-N-propylbenzamide
CID 63230394
N-(2-aminophenyl)-2-bromo-4-chloro-N-propylbenzamide
CID 107986331
N-(2-aminophenyl)-N-propylfuran-2-carboxamide
CID 63230481
N-[(2-aminophenyl)methyl]-N-ethyl-2,5-dimethylfuran-3-carboxamide
CID 43459243
N-(2-aminophenyl)-4,5-dimethyl-N-propylthiophene-2-carboxamide
CID 65237112
N-(2-aminophenyl)-3-chloro-4-methyl-N-propylbenzamide
CID 63230488
N-(4-aminophenyl)-N-ethyl-2,5-dimethylfuran-3-carboxamide
CID 55175946
N-(2-aminophenyl)-N-propylbutanamide
CID 63230657
N-(2-aminophenyl)-N-propylpyridine-2-carboxamide
CID 63230351
1-(2-aminophenyl)-3,3-diethyl-1-propylurea
CID 79154664
N-(2-aminophenyl)-3-ethyl-N-propylthiophene-2-carboxamide
CID 79985121

Frequently Asked Questions

What is the IUPAC name of N-(2-aminophenyl)-2,5-dimethyl-N-propylfuran-3-carboxamide?
The IUPAC name of N-(2-aminophenyl)-2,5-dimethyl-N-propylfuran-3-carboxamide (CID 63230482) is N-(2-aminophenyl)-2,5-dimethyl-N-propylfuran-3-carboxamide.
What is the SMILES notation for N-(2-aminophenyl)-2,5-dimethyl-N-propylfuran-3-carboxamide?
The canonical SMILES for N-(2-aminophenyl)-2,5-dimethyl-N-propylfuran-3-carboxamide is CCCN(C(=O)c1cc(C)oc1C)c1ccccc1N.
What is the InChIKey of N-(2-aminophenyl)-2,5-dimethyl-N-propylfuran-3-carboxamide?
The InChIKey is HXJADPMCEMVQRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O2/c1-4-9-18(15-8-6-5-7-14(15)17)16(19)13-10-11(2)20-12(13)3/h5-8,10H,4,9,17H2,1-3H3.
What are the key properties of N-(2-aminophenyl)-2,5-dimethyl-N-propylfuran-3-carboxamide?
N-(2-aminophenyl)-2,5-dimethyl-N-propylfuran-3-carboxamide has a molecular weight of 272.35 g/mol, XLogP of 3.54, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminophenyl)-2,5-dimethyl-N-propylfuran-3-carboxamide is sourced from PubChem (CID 63230482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).