3-(naphthalen-2-ylcarbamoylamino)propanamide

C14H15N3O2 — CID 23023573

IUPAC3-(naphthalen-2-ylcarbamoylamino)propanamide
SMILESNC(=O)CCNC(=O)Nc1ccc2ccccc2c1
InChIInChI=1S/C14H15N3O2/c15-13(18)7-8-16-14(19)17-12-6-5-10-3-1-2-4-11(10)9-12/h1-6,9H,7-8H2,(H2,15,18)(H2,16,17,19)
InChIKeyPHWXPQDXBAGLQZ-UHFFFAOYSA-N
MW257.29 g/mol
LogP1.84
Rot. Bonds4

About 3-(naphthalen-2-ylcarbamoylamino)propanamide

3-(naphthalen-2-ylcarbamoylamino)propanamide (PubChem CID 23023573) has the molecular formula C14H15N3O2 and a molecular weight of 257.29 g/mol. Its IUPAC name is 3-(naphthalen-2-ylcarbamoylamino)propanamide.

Molecular Properties

Compound Name3-(naphthalen-2-ylcarbamoylamino)propanamide
PubChem CID23023573
Molecular FormulaC14H15N3O2
Molecular Weight257.29 g/mol
Exact Mass257.12
IUPAC Name3-(naphthalen-2-ylcarbamoylamino)propanamide
SMILESNC(=O)CCNC(=O)Nc1ccc2ccccc2c1
InChIInChI=1S/C14H15N3O2/c15-13(18)7-8-16-14(19)17-12-6-5-10-3-1-2-4-11(10)9-12/h1-6,9H,7-8H2,(H2,15,18)(H2,16,17,19)
InChIKeyPHWXPQDXBAGLQZ-UHFFFAOYSA-N
XLogP1.84
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.29
LogP ≤ 51.84
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3-hydroxybutyl)-3-naphthalen-2-ylurea
CID 111336742
3-[(3-aminophenyl)carbamoylamino]propanamide
CID 43553830
(2S)-2-amino-N-naphthalen-2-ylpentanediamide
CID 7020027
1-[2-(3-bromophenyl)ethyl]-3-naphthalen-2-ylurea
CID 108901727
1-methyl-3-naphthalen-2-ylurea
CID 3454681
3-[(3,5-dichlorophenyl)carbamoylamino]propanamide
CID 56814254
1-(3,4-dimethylphenyl)-3-naphthalen-2-ylurea
CID 108894077
1-(2-methoxyethoxymethyl)-3-naphthalen-2-ylurea
CID 108894459
1-naphthalen-2-yl-3-[2-(4-pyrazol-1-ylphenyl)ethyl]urea
CID 78871809
1-[3-(4-tert-butylphenoxy)propyl]-3-naphthalen-2-ylurea
CID 108882865
1-[2-(1,3-benzothiazol-2-yl)ethyl]-3-naphthalen-2-ylurea
CID 78832241
3-(ethylamino)-N-naphthalen-2-ylpropanamide
CID 62833227

Frequently Asked Questions

What is the IUPAC name of 3-(naphthalen-2-ylcarbamoylamino)propanamide?
The IUPAC name of 3-(naphthalen-2-ylcarbamoylamino)propanamide (CID 23023573) is 3-(naphthalen-2-ylcarbamoylamino)propanamide.
What is the SMILES notation for 3-(naphthalen-2-ylcarbamoylamino)propanamide?
The canonical SMILES for 3-(naphthalen-2-ylcarbamoylamino)propanamide is NC(=O)CCNC(=O)Nc1ccc2ccccc2c1.
What is the InChIKey of 3-(naphthalen-2-ylcarbamoylamino)propanamide?
The InChIKey is PHWXPQDXBAGLQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O2/c15-13(18)7-8-16-14(19)17-12-6-5-10-3-1-2-4-11(10)9-12/h1-6,9H,7-8H2,(H2,15,18)(H2,16,17,19).
What are the key properties of 3-(naphthalen-2-ylcarbamoylamino)propanamide?
3-(naphthalen-2-ylcarbamoylamino)propanamide has a molecular weight of 257.29 g/mol, XLogP of 1.84, 4 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(naphthalen-2-ylcarbamoylamino)propanamide is sourced from PubChem (CID 23023573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).