2-amino-5-(3-hydroxypropoxy)benzamide

C10H14N2O3 — CID 61307251

IUPAC2-amino-5-(3-hydroxypropoxy)benzamide
SMILESNC(=O)c1cc(OCCCO)ccc1N
InChIInChI=1S/C10H14N2O3/c11-9-3-2-7(15-5-1-4-13)6-8(9)10(12)14/h2-3,6,13H,1,4-5,11H2,(H2,12,14)
InChIKeyBCYOLLRHOFGYMM-UHFFFAOYSA-N
MW210.23 g/mol
LogP0.13
Rot. Bonds5

About 2-amino-5-(3-hydroxypropoxy)benzamide

2-amino-5-(3-hydroxypropoxy)benzamide (PubChem CID 61307251) has the molecular formula C10H14N2O3 and a molecular weight of 210.23 g/mol. Its IUPAC name is 2-amino-5-(3-hydroxypropoxy)benzamide.

Molecular Properties

Compound Name2-amino-5-(3-hydroxypropoxy)benzamide
PubChem CID61307251
Molecular FormulaC10H14N2O3
Molecular Weight210.23 g/mol
Exact Mass210.10
IUPAC Name2-amino-5-(3-hydroxypropoxy)benzamide
SMILESNC(=O)c1cc(OCCCO)ccc1N
InChIInChI=1S/C10H14N2O3/c11-9-3-2-7(15-5-1-4-13)6-8(9)10(12)14/h2-3,6,13H,1,4-5,11H2,(H2,12,14)
InChIKeyBCYOLLRHOFGYMM-UHFFFAOYSA-N
XLogP0.13
TPSA98.57 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.23
LogP ≤ 50.13
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-amino-5-(2-butoxyethoxy)benzamide
CID 61307409
2-amino-5-(2-ethoxyethoxy)benzamide
CID 61306678
2-amino-5-(3-pyridin-4-ylpropoxy)benzamide
CID 61306005
2-amino-5-[2-[di(propan-2-yl)amino]ethoxy]benzamide
CID 115505667
2-amino-5-(2-hydroxyethoxy)-N-methylbenzamide
CID 70096875
2-amino-5-(cyclopropylmethoxy)benzamide
CID 61305267
2-amino-5-methoxybenzamide;ethane
CID 142071126
2-amino-5-propoxybenzoic acid
CID 12719187
4-amino-3-(3-hydroxypropoxy)benzamide
CID 63356843
2-amino-5-(2-methoxyethoxy)benzoic acid
CID 12719199
2-amino-5-heptoxybenzoic acid
CID 54888058
2-amino-5-[2-(4-bromophenoxy)ethoxy]benzoic acid
CID 107077092

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-(3-hydroxypropoxy)benzamide?
The IUPAC name of 2-amino-5-(3-hydroxypropoxy)benzamide (CID 61307251) is 2-amino-5-(3-hydroxypropoxy)benzamide.
What is the SMILES notation for 2-amino-5-(3-hydroxypropoxy)benzamide?
The canonical SMILES for 2-amino-5-(3-hydroxypropoxy)benzamide is NC(=O)c1cc(OCCCO)ccc1N.
What is the InChIKey of 2-amino-5-(3-hydroxypropoxy)benzamide?
The InChIKey is BCYOLLRHOFGYMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O3/c11-9-3-2-7(15-5-1-4-13)6-8(9)10(12)14/h2-3,6,13H,1,4-5,11H2,(H2,12,14).
What are the key properties of 2-amino-5-(3-hydroxypropoxy)benzamide?
2-amino-5-(3-hydroxypropoxy)benzamide has a molecular weight of 210.23 g/mol, XLogP of 0.13, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-(3-hydroxypropoxy)benzamide is sourced from PubChem (CID 61307251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).