(2S)-2-amino-N-naphthalen-2-ylpentanediamide

C15H17N3O2 — CID 7020027

IUPAC(2S)-2-amino-N-naphthalen-2-ylpentanediamide
SMILESNC(=O)CC[C@H](N)C(=O)Nc1ccc2ccccc2c1
InChIInChI=1S/C15H17N3O2/c16-13(7-8-14(17)19)15(20)18-12-6-5-10-3-1-2-4-11(10)9-12/h1-6,9,13H,7-8,16H2,(H2,17,19)(H,18,20)/t13-/m0/s1
InChIKeySCBLXQAXDOWFIH-ZDUSSCGKSA-N
MW271.32 g/mol
LogP1.37
Rot. Bonds5

About (2S)-2-amino-N-naphthalen-2-ylpentanediamide

(2S)-2-amino-N-naphthalen-2-ylpentanediamide (PubChem CID 7020027) has the molecular formula C15H17N3O2 and a molecular weight of 271.32 g/mol. Its IUPAC name is (2S)-2-amino-N-naphthalen-2-ylpentanediamide.

Molecular Properties

Compound Name(2S)-2-amino-N-naphthalen-2-ylpentanediamide
PubChem CID7020027
Molecular FormulaC15H17N3O2
Molecular Weight271.32 g/mol
Exact Mass271.13
IUPAC Name(2S)-2-amino-N-naphthalen-2-ylpentanediamide
SMILESNC(=O)CC[C@H](N)C(=O)Nc1ccc2ccccc2c1
InChIInChI=1S/C15H17N3O2/c16-13(7-8-14(17)19)15(20)18-12-6-5-10-3-1-2-4-11(10)9-12/h1-6,9,13H,7-8,16H2,(H2,17,19)(H,18,20)/t13-/m0/s1
InChIKeySCBLXQAXDOWFIH-ZDUSSCGKSA-N
XLogP1.37
TPSA98.21 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 51.37
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-isoquinolin-6-ylpentanediamide
CID 135200054
carbonic acid;(2S)-2,5-diamino-N-naphthalen-2-ylpentanamide
CID 90473324
2-amino-4-methylsulfanyl-N-naphthalen-2-ylbutanamide;hydrochloride
CID 18408186
2-amino-5-methoxy-N-naphthalen-2-ylpentanamide
CID 81083067
2-amino-N-naphthalen-2-yl-3-phenylpropanamide
CID 577793
2-amino-5-(diaminomethylideneamino)-N-naphthalen-2-ylpentanamide;hydron;chloride
CID 74765110
(2S)-2-amino-N-(4-benzylphenyl)pentanediamide
CID 134586537
2-amino-4-methyl-N-naphthalen-2-ylpentanamide chloride
CID 5351894
3-(naphthalen-2-ylcarbamoylamino)propanamide
CID 23023573
(2R)-2-amino-3-methyl-N-naphthalen-2-ylbutanamide
CID 671224
(2S)-2-amino-3-(1H-imidazol-5-yl)-N-naphthalen-2-ylpropanamide
CID 688489
(2S)-2-amino-N-(6-bromonaphthalen-2-yl)-4-methylsulfanylbutanamide
CID 81259945

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-N-naphthalen-2-ylpentanediamide?
The IUPAC name of (2S)-2-amino-N-naphthalen-2-ylpentanediamide (CID 7020027) is (2S)-2-amino-N-naphthalen-2-ylpentanediamide.
What is the SMILES notation for (2S)-2-amino-N-naphthalen-2-ylpentanediamide?
The canonical SMILES for (2S)-2-amino-N-naphthalen-2-ylpentanediamide is NC(=O)CC[C@H](N)C(=O)Nc1ccc2ccccc2c1.
What is the InChIKey of (2S)-2-amino-N-naphthalen-2-ylpentanediamide?
The InChIKey is SCBLXQAXDOWFIH-ZDUSSCGKSA-N. The full InChI is InChI=1S/C15H17N3O2/c16-13(7-8-14(17)19)15(20)18-12-6-5-10-3-1-2-4-11(10)9-12/h1-6,9,13H,7-8,16H2,(H2,17,19)(H,18,20)/t13-/m0/s1.
What are the key properties of (2S)-2-amino-N-naphthalen-2-ylpentanediamide?
(2S)-2-amino-N-naphthalen-2-ylpentanediamide has a molecular weight of 271.32 g/mol, XLogP of 1.37, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-N-naphthalen-2-ylpentanediamide is sourced from PubChem (CID 7020027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).