2-hydroxy-3-[[(2-methylphenyl)-phenylmethyl]amino]propanamide

C17H20N2O2 — CID 106171878

IUPAC2-hydroxy-3-[[(2-methylphenyl)-phenylmethyl]amino]propanamide
SMILESCc1ccccc1C(NCC(O)C(N)=O)c1ccccc1
InChIInChI=1S/C17H20N2O2/c1-12-7-5-6-10-14(12)16(13-8-3-2-4-9-13)19-11-15(20)17(18)21/h2-10,15-16,19-20H,11H2,1H3,(H2,18,21)
InChIKeyWZHRQUBSNIRHTN-UHFFFAOYSA-N
MW284.36 g/mol
LogP1.52
Rot. Bonds6

About 2-hydroxy-3-[[(2-methylphenyl)-phenylmethyl]amino]propanamide

2-hydroxy-3-[[(2-methylphenyl)-phenylmethyl]amino]propanamide (PubChem CID 106171878) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is 2-hydroxy-3-[[(2-methylphenyl)-phenylmethyl]amino]propanamide.

Molecular Properties

Compound Name2-hydroxy-3-[[(2-methylphenyl)-phenylmethyl]amino]propanamide
PubChem CID106171878
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC Name2-hydroxy-3-[[(2-methylphenyl)-phenylmethyl]amino]propanamide
SMILESCc1ccccc1C(NCC(O)C(N)=O)c1ccccc1
InChIInChI=1S/C17H20N2O2/c1-12-7-5-6-10-14(12)16(13-8-3-2-4-9-13)19-11-15(20)17(18)21/h2-10,15-16,19-20H,11H2,1H3,(H2,18,21)
InChIKeyWZHRQUBSNIRHTN-UHFFFAOYSA-N
XLogP1.52
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 51.52
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

3-[[(4-fluorophenyl)-phenylmethyl]amino]-2-hydroxypropanamide
CID 106171119
[(R)-(2-methylphenyl)-phenylmethyl]urea
CID 870913
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CID 79481070
N-methyl-2-[[(2-methylphenyl)-phenylmethyl]amino]acetamide
CID 78913864
4-[[(2-methylphenyl)-phenylmethyl]amino]butanoic acid
CID 79481040
2-[[(2-methylphenyl)-phenylmethyl]amino]oxyacetamide
CID 115992033
2-methyl-3-[[(2-methylphenyl)-phenylmethyl]amino]propanenitrile
CID 79471754
3-(benzhydrylamino)-2-methylpropanamide
CID 43312171
1-methoxy-4-[[(2-methylphenyl)-phenylmethyl]amino]butan-2-ol
CID 110011394
2-methyl-N-[(S)-(2-methylphenyl)-phenylmethyl]propanamide
CID 100583680
2-hydroxy-3-(2-phenylpropanoylamino)propanamide
CID 107260947
2-methyl-N-[(R)-(2-methylphenyl)-phenylmethyl]benzamide
CID 28578946

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-3-[[(2-methylphenyl)-phenylmethyl]amino]propanamide?
The IUPAC name of 2-hydroxy-3-[[(2-methylphenyl)-phenylmethyl]amino]propanamide (CID 106171878) is 2-hydroxy-3-[[(2-methylphenyl)-phenylmethyl]amino]propanamide.
What is the SMILES notation for 2-hydroxy-3-[[(2-methylphenyl)-phenylmethyl]amino]propanamide?
The canonical SMILES for 2-hydroxy-3-[[(2-methylphenyl)-phenylmethyl]amino]propanamide is Cc1ccccc1C(NCC(O)C(N)=O)c1ccccc1.
What is the InChIKey of 2-hydroxy-3-[[(2-methylphenyl)-phenylmethyl]amino]propanamide?
The InChIKey is WZHRQUBSNIRHTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c1-12-7-5-6-10-14(12)16(13-8-3-2-4-9-13)19-11-15(20)17(18)21/h2-10,15-16,19-20H,11H2,1H3,(H2,18,21).
What are the key properties of 2-hydroxy-3-[[(2-methylphenyl)-phenylmethyl]amino]propanamide?
2-hydroxy-3-[[(2-methylphenyl)-phenylmethyl]amino]propanamide has a molecular weight of 284.36 g/mol, XLogP of 1.52, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-3-[[(2-methylphenyl)-phenylmethyl]amino]propanamide is sourced from PubChem (CID 106171878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).