2-hydroxy-3-(naphthalen-1-ylcarbamoylamino)propanamide

C14H15N3O3 — CID 107258515

IUPAC2-hydroxy-3-(naphthalen-1-ylcarbamoylamino)propanamide
SMILESNC(=O)C(O)CNC(=O)Nc1cccc2ccccc12
InChIInChI=1S/C14H15N3O3/c15-13(19)12(18)8-16-14(20)17-11-7-3-5-9-4-1-2-6-10(9)11/h1-7,12,18H,8H2,(H2,15,19)(H2,16,17,20)
InChIKeyRHZPZMDLLNSSAK-UHFFFAOYSA-N
MW273.29 g/mol
LogP0.81
Rot. Bonds4

About 2-hydroxy-3-(naphthalen-1-ylcarbamoylamino)propanamide

2-hydroxy-3-(naphthalen-1-ylcarbamoylamino)propanamide (PubChem CID 107258515) has the molecular formula C14H15N3O3 and a molecular weight of 273.29 g/mol. Its IUPAC name is 2-hydroxy-3-(naphthalen-1-ylcarbamoylamino)propanamide.

Molecular Properties

Compound Name2-hydroxy-3-(naphthalen-1-ylcarbamoylamino)propanamide
PubChem CID107258515
Molecular FormulaC14H15N3O3
Molecular Weight273.29 g/mol
Exact Mass273.11
IUPAC Name2-hydroxy-3-(naphthalen-1-ylcarbamoylamino)propanamide
SMILESNC(=O)C(O)CNC(=O)Nc1cccc2ccccc12
InChIInChI=1S/C14H15N3O3/c15-13(19)12(18)8-16-14(20)17-11-7-3-5-9-4-1-2-6-10(9)11/h1-7,12,18H,8H2,(H2,15,19)(H2,16,17,20)
InChIKeyRHZPZMDLLNSSAK-UHFFFAOYSA-N
XLogP0.81
TPSA104.45 Ų
H-Bond Donors4
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.29
LogP ≤ 50.81
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-hydroxypropyl)-3-naphthalen-1-ylurea
CID 17468556
1-(3-amino-3-sulfanylidenepropyl)-3-naphthalen-1-ylurea
CID 62667648
2-hydroxy-4-(naphthalen-1-ylcarbamoylamino)butanoic acid
CID 107835055
1-naphthalen-1-yl-3-[2-(naphthalen-1-ylcarbamoylamino)phenyl]urea
CID 177491059
1-naphthalen-1-yl-3-[5-(naphthalen-1-ylcarbamoylamino)naphthalen-1-yl]urea
CID 27190755
naphthalen-1-ylurea;hydrochloride
CID 141142203
1-naphthalen-1-yl-3-(naphthalen-1-ylmethyl)urea
CID 27185701
1-(2,3-dihydroxy-2-methylpropyl)-3-naphthalen-1-ylurea
CID 66170746
1-naphthalen-1-yl-3-(3-oxobutyl)urea
CID 108895153
1-naphthalen-1-yl-3-[4-(naphthalen-1-ylcarbamoylamino)phenyl]urea
CID 23966866
1-naphthalen-1-yl-3-[2-(propan-2-ylamino)ethyl]urea
CID 62664928
1-[2-[(dimethylamino)methyl]-3-hydroxy-3-phenylpropyl]-3-naphthalen-1-ylurea
CID 42959034

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-3-(naphthalen-1-ylcarbamoylamino)propanamide?
The IUPAC name of 2-hydroxy-3-(naphthalen-1-ylcarbamoylamino)propanamide (CID 107258515) is 2-hydroxy-3-(naphthalen-1-ylcarbamoylamino)propanamide.
What is the SMILES notation for 2-hydroxy-3-(naphthalen-1-ylcarbamoylamino)propanamide?
The canonical SMILES for 2-hydroxy-3-(naphthalen-1-ylcarbamoylamino)propanamide is NC(=O)C(O)CNC(=O)Nc1cccc2ccccc12.
What is the InChIKey of 2-hydroxy-3-(naphthalen-1-ylcarbamoylamino)propanamide?
The InChIKey is RHZPZMDLLNSSAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O3/c15-13(19)12(18)8-16-14(20)17-11-7-3-5-9-4-1-2-6-10(9)11/h1-7,12,18H,8H2,(H2,15,19)(H2,16,17,20).
What are the key properties of 2-hydroxy-3-(naphthalen-1-ylcarbamoylamino)propanamide?
2-hydroxy-3-(naphthalen-1-ylcarbamoylamino)propanamide has a molecular weight of 273.29 g/mol, XLogP of 0.81, 4 rotatable bonds, 4 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-3-(naphthalen-1-ylcarbamoylamino)propanamide is sourced from PubChem (CID 107258515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).