2-amino-N-(2-hydroxypropyl)benzamide;hydrochloride

C10H15ClN2O2 — CID 142025240

IUPAC2-amino-N-(2-hydroxypropyl)benzamide;hydrochloride
SMILESCC(O)CNC(=O)c1ccccc1N.Cl
InChIInChI=1S/C10H14N2O2.ClH/c1-7(13)6-12-10(14)8-4-2-3-5-9(8)11;/h2-5,7,13H,6,11H2,1H3,(H,12,14);1H
InChIKeyQFCUGNTYZDMGTE-UHFFFAOYSA-N
MW230.70 g/mol
LogP0.80
Rot. Bonds3

About 2-amino-N-(2-hydroxypropyl)benzamide;hydrochloride

2-amino-N-(2-hydroxypropyl)benzamide;hydrochloride (PubChem CID 142025240) has the molecular formula C10H15ClN2O2 and a molecular weight of 230.70 g/mol. Its IUPAC name is 2-amino-N-(2-hydroxypropyl)benzamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-(2-hydroxypropyl)benzamide;hydrochloride
PubChem CID142025240
Molecular FormulaC10H15ClN2O2
Molecular Weight230.70 g/mol
Exact Mass230.08
IUPAC Name2-amino-N-(2-hydroxypropyl)benzamide;hydrochloride
SMILESCC(O)CNC(=O)c1ccccc1N.Cl
InChIInChI=1S/C10H14N2O2.ClH/c1-7(13)6-12-10(14)8-4-2-3-5-9(8)11;/h2-5,7,13H,6,11H2,1H3,(H,12,14);1H
InChIKeyQFCUGNTYZDMGTE-UHFFFAOYSA-N
XLogP0.80
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.70
LogP ≤ 50.80
H-Bond Donors ≤ 53
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-hydroxypropyl)benzamide
CID 12562298
3-amino-N-[(2S)-2-hydroxypropyl]-2-methoxybenzamide
CID 107211143
2-amino-N-(4-hydroxypentyl)benzamide
CID 106118828
2-fluoro-N-(2-hydroxypropyl)benzamide
CID 43391205
3-amino-2-ethoxy-N-(2-hydroxypropyl)benzamide
CID 113386382
4-amino-N-(2-hydroxypropyl)pyridine-3-carboxamide
CID 123975381
2-amino-3-fluoro-N-[(2R)-2-hydroxypropyl]benzamide
CID 96696408
2,3-dihydroxy-N-(2-hydroxypropyl)benzamide
CID 114344897
2-tert-butyl-N-[(2R)-2-hydroxypropyl]benzamide
CID 83031297
2-amino-N-[4-(dimethylamino)-2-ethoxybutyl]benzamide;dihydrochloride
CID 119947402
2-bromo-N-[(2R)-2-hydroxypropyl]pyridine-3-carboxamide
CID 103886003
5-amino-2-bromo-N-[(2R)-2-hydroxypropyl]benzamide
CID 107211065

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2-hydroxypropyl)benzamide;hydrochloride?
The IUPAC name of 2-amino-N-(2-hydroxypropyl)benzamide;hydrochloride (CID 142025240) is 2-amino-N-(2-hydroxypropyl)benzamide;hydrochloride.
What is the SMILES notation for 2-amino-N-(2-hydroxypropyl)benzamide;hydrochloride?
The canonical SMILES for 2-amino-N-(2-hydroxypropyl)benzamide;hydrochloride is CC(O)CNC(=O)c1ccccc1N.Cl.
What is the InChIKey of 2-amino-N-(2-hydroxypropyl)benzamide;hydrochloride?
The InChIKey is QFCUGNTYZDMGTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O2.ClH/c1-7(13)6-12-10(14)8-4-2-3-5-9(8)11;/h2-5,7,13H,6,11H2,1H3,(H,12,14);1H.
What are the key properties of 2-amino-N-(2-hydroxypropyl)benzamide;hydrochloride?
2-amino-N-(2-hydroxypropyl)benzamide;hydrochloride has a molecular weight of 230.70 g/mol, XLogP of 0.80, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2-hydroxypropyl)benzamide;hydrochloride is sourced from PubChem (CID 142025240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).