N-[2-(hydroxymethylamino)ethyl]benzamide

C10H14N2O2 — CID 89240823

IUPACN-[2-(hydroxymethylamino)ethyl]benzamide
SMILESO=C(NCCNCO)c1ccccc1
InChIInChI=1S/C10H14N2O2/c13-8-11-6-7-12-10(14)9-4-2-1-3-5-9/h1-5,11,13H,6-8H2,(H,12,14)
InChIKeyBLUCIQARYZJQBG-UHFFFAOYSA-N
MW194.23 g/mol
LogP-0.04
Rot. Bonds5

About N-[2-(hydroxymethylamino)ethyl]benzamide

N-[2-(hydroxymethylamino)ethyl]benzamide (PubChem CID 89240823) has the molecular formula C10H14N2O2 and a molecular weight of 194.23 g/mol. Its IUPAC name is N-[2-(hydroxymethylamino)ethyl]benzamide.

Molecular Properties

Compound NameN-[2-(hydroxymethylamino)ethyl]benzamide
PubChem CID89240823
Molecular FormulaC10H14N2O2
Molecular Weight194.23 g/mol
Exact Mass194.11
IUPAC NameN-[2-(hydroxymethylamino)ethyl]benzamide
SMILESO=C(NCCNCO)c1ccccc1
InChIInChI=1S/C10H14N2O2/c13-8-11-6-7-12-10(14)9-4-2-1-3-5-9/h1-5,11,13H,6-8H2,(H,12,14)
InChIKeyBLUCIQARYZJQBG-UHFFFAOYSA-N
XLogP-0.04
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 5-0.04
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

N-[2-[2-(2-benzamidoethylamino)ethylamino]ethyl]benzamide
CID 86227273
benzoic acid;N-(2-hydroxyethyl)benzamide
CID 68510330
N-[2-(methylcarbamoylamino)ethyl]benzamide
CID 47152136
N-[2-oxo-2-[2-(propylamino)ethylamino]ethyl]benzamide
CID 62658623
N-(2-benzamidoethyl)-4-ethylbenzamide
CID 84532761
2-benzamidoacetic acid;hydrofluoride
CID 174760685
2-benzamidoethyl(chloro)mercury
CID 70399484
N-(2-aminoethyl)benzamide;ethane
CID 143976252
N-[2-(cyclobutene-1-carbonylamino)ethyl]benzamide
CID 75440243
N-(2-benzamidoethyl)-4-(dimethylamino)benzamide
CID 38175898
N-[2-(pyrimidin-2-ylamino)ethyl]benzamide
CID 31658784
N-(3-phenylbutyl)benzamide
CID 62403316

Frequently Asked Questions

What is the IUPAC name of N-[2-(hydroxymethylamino)ethyl]benzamide?
The IUPAC name of N-[2-(hydroxymethylamino)ethyl]benzamide (CID 89240823) is N-[2-(hydroxymethylamino)ethyl]benzamide.
What is the SMILES notation for N-[2-(hydroxymethylamino)ethyl]benzamide?
The canonical SMILES for N-[2-(hydroxymethylamino)ethyl]benzamide is O=C(NCCNCO)c1ccccc1.
What is the InChIKey of N-[2-(hydroxymethylamino)ethyl]benzamide?
The InChIKey is BLUCIQARYZJQBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O2/c13-8-11-6-7-12-10(14)9-4-2-1-3-5-9/h1-5,11,13H,6-8H2,(H,12,14).
What are the key properties of N-[2-(hydroxymethylamino)ethyl]benzamide?
N-[2-(hydroxymethylamino)ethyl]benzamide has a molecular weight of 194.23 g/mol, XLogP of -0.04, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(hydroxymethylamino)ethyl]benzamide is sourced from PubChem (CID 89240823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).