2-amino-5-methoxy-N-propylbenzamide

C11H16N2O2 — CID 60954595

IUPAC2-amino-5-methoxy-N-propylbenzamide
SMILESCCCNC(=O)c1cc(OC)ccc1N
InChIInChI=1S/C11H16N2O2/c1-3-6-13-11(14)9-7-8(15-2)4-5-10(9)12/h4-5,7H,3,6,12H2,1-2H3,(H,13,14)
InChIKeyITSAMDQUOQIKPP-UHFFFAOYSA-N
MW208.26 g/mol
LogP1.42
Rot. Bonds4

About 2-amino-5-methoxy-N-propylbenzamide

2-amino-5-methoxy-N-propylbenzamide (PubChem CID 60954595) has the molecular formula C11H16N2O2 and a molecular weight of 208.26 g/mol. Its IUPAC name is 2-amino-5-methoxy-N-propylbenzamide.

Molecular Properties

Compound Name2-amino-5-methoxy-N-propylbenzamide
PubChem CID60954595
Molecular FormulaC11H16N2O2
Molecular Weight208.26 g/mol
Exact Mass208.12
IUPAC Name2-amino-5-methoxy-N-propylbenzamide
SMILESCCCNC(=O)c1cc(OC)ccc1N
InChIInChI=1S/C11H16N2O2/c1-3-6-13-11(14)9-7-8(15-2)4-5-10(9)12/h4-5,7H,3,6,12H2,1-2H3,(H,13,14)
InChIKeyITSAMDQUOQIKPP-UHFFFAOYSA-N
XLogP1.42
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 51.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-amino-N-(2-hydroxyethyl)-5-methoxybenzamide
CID 60954479
2-amino-5-methoxy-N-(3-methoxypropyl)benzamide
CID 54878569
2-amino-N-(3-hydroxybutyl)-5-methoxybenzamide
CID 64927216
2-amino-N-(2-cyanoethyl)-5-methoxybenzamide
CID 115412506
2-amino-5-methoxy-N-(4,4,4-trifluorobutyl)benzamide
CID 115514769
2-amino-N-(2-hydroxy-2-methylpentyl)-5-methoxybenzamide
CID 106289273
2-amino-N-[2-(4-chlorophenyl)ethyl]-5-methoxybenzamide
CID 61117267
2-amino-N-(2,2-difluoroethyl)-5-methoxybenzamide
CID 115405286
2-amino-5-methoxy-N-[2-(2-methylphenyl)ethyl]benzamide
CID 79756137
5-[(2-amino-5-methoxybenzoyl)amino]-2-methylpentanoic acid
CID 104685620
2-amino-N-[2-(azepan-1-yl)ethyl]-5-methoxybenzamide
CID 61241340
2-amino-N-(3-ethyl-2-hydroxypentyl)-5-methoxybenzamide
CID 106284093

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-methoxy-N-propylbenzamide?
The IUPAC name of 2-amino-5-methoxy-N-propylbenzamide (CID 60954595) is 2-amino-5-methoxy-N-propylbenzamide.
What is the SMILES notation for 2-amino-5-methoxy-N-propylbenzamide?
The canonical SMILES for 2-amino-5-methoxy-N-propylbenzamide is CCCNC(=O)c1cc(OC)ccc1N.
What is the InChIKey of 2-amino-5-methoxy-N-propylbenzamide?
The InChIKey is ITSAMDQUOQIKPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2/c1-3-6-13-11(14)9-7-8(15-2)4-5-10(9)12/h4-5,7H,3,6,12H2,1-2H3,(H,13,14).
What are the key properties of 2-amino-5-methoxy-N-propylbenzamide?
2-amino-5-methoxy-N-propylbenzamide has a molecular weight of 208.26 g/mol, XLogP of 1.42, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-methoxy-N-propylbenzamide is sourced from PubChem (CID 60954595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).