3-amino-N-(2-amino-1-naphthalen-2-ylethyl)propanamide

C15H19N3O — CID 122081221

IUPAC3-amino-N-(2-amino-1-naphthalen-2-ylethyl)propanamide
SMILESNCCC(=O)NC(CN)c1ccc2ccccc2c1
InChIInChI=1S/C15H19N3O/c16-8-7-15(19)18-14(10-17)13-6-5-11-3-1-2-4-12(11)9-13/h1-6,9,14H,7-8,10,16-17H2,(H,18,19)
InChIKeySRPBKQBDPUKZSG-UHFFFAOYSA-N
MW257.34 g/mol
LogP1.30
Rot. Bonds5

About 3-amino-N-(2-amino-1-naphthalen-2-ylethyl)propanamide

3-amino-N-(2-amino-1-naphthalen-2-ylethyl)propanamide (PubChem CID 122081221) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is 3-amino-N-(2-amino-1-naphthalen-2-ylethyl)propanamide.

Molecular Properties

Compound Name3-amino-N-(2-amino-1-naphthalen-2-ylethyl)propanamide
PubChem CID122081221
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC Name3-amino-N-(2-amino-1-naphthalen-2-ylethyl)propanamide
SMILESNCCC(=O)NC(CN)c1ccc2ccccc2c1
InChIInChI=1S/C15H19N3O/c16-8-7-15(19)18-14(10-17)13-6-5-11-3-1-2-4-12(11)9-13/h1-6,9,14H,7-8,10,16-17H2,(H,18,19)
InChIKeySRPBKQBDPUKZSG-UHFFFAOYSA-N
XLogP1.30
TPSA81.14 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 51.30
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-amino-1-naphthalen-2-ylethyl)-3-methylbutanamide
CID 120567667
N-(2-amino-1-naphthalen-2-ylethyl)-4-methylsulfanylbutanamide;hydrochloride
CID 120567970
N-[2-[(2-amino-1-naphthalen-2-ylethyl)amino]-2-oxoethyl]-3,3-dimethylbutanamide;hydrochloride
CID 120567986
N-(2-amino-1-naphthalen-2-ylethyl)-3-(oxan-2-yl)propanamide
CID 120567831
N-(2-amino-1-naphthalen-2-ylethyl)-3-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)propanamide
CID 120567791
N-(2-amino-1-naphthalen-2-ylethyl)-4-pyrrolidin-1-ylsulfonylbutanamide;hydrochloride
CID 120567466
3-acetamido-N-(2-amino-1-naphthalen-2-ylethyl)-3-(4-methylphenyl)propanamide
CID 120567799
N-(2-amino-1-naphthalen-2-ylethyl)-3-(1,3,5-trimethylpyrazol-4-yl)propanamide;dihydrochloride
CID 120567448
3-acetamido-N-(2-amino-1-naphthalen-2-ylethyl)-3-(4-methylphenyl)propanamide;hydrochloride
CID 120567798
N-(2-amino-1-naphthalen-2-ylethyl)-2-prop-2-enylpent-4-enamide;hydrochloride
CID 120567542
N-(2-amino-1-naphthalen-2-ylethyl)-4-(3-propyl-1,2,4-oxadiazol-5-yl)butanamide;hydrochloride
CID 120567918
N-(2-amino-1-naphthalen-2-ylethyl)-2-[(3-methyl-1,2,4-oxadiazol-5-yl)methoxy]acetamide
CID 120567691

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(2-amino-1-naphthalen-2-ylethyl)propanamide?
The IUPAC name of 3-amino-N-(2-amino-1-naphthalen-2-ylethyl)propanamide (CID 122081221) is 3-amino-N-(2-amino-1-naphthalen-2-ylethyl)propanamide.
What is the SMILES notation for 3-amino-N-(2-amino-1-naphthalen-2-ylethyl)propanamide?
The canonical SMILES for 3-amino-N-(2-amino-1-naphthalen-2-ylethyl)propanamide is NCCC(=O)NC(CN)c1ccc2ccccc2c1.
What is the InChIKey of 3-amino-N-(2-amino-1-naphthalen-2-ylethyl)propanamide?
The InChIKey is SRPBKQBDPUKZSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c16-8-7-15(19)18-14(10-17)13-6-5-11-3-1-2-4-12(11)9-13/h1-6,9,14H,7-8,10,16-17H2,(H,18,19).
What are the key properties of 3-amino-N-(2-amino-1-naphthalen-2-ylethyl)propanamide?
3-amino-N-(2-amino-1-naphthalen-2-ylethyl)propanamide has a molecular weight of 257.34 g/mol, XLogP of 1.30, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(2-amino-1-naphthalen-2-ylethyl)propanamide is sourced from PubChem (CID 122081221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).