(2R)-2-amino-N-(6-bromonaphthalen-2-yl)-4-methylpentanamide

C16H19BrN2O — CID 104903779

IUPAC(2R)-2-amino-N-(6-bromonaphthalen-2-yl)-4-methylpentanamide
SMILESCC(C)C[C@@H](N)C(=O)Nc1ccc2cc(Br)ccc2c1
InChIInChI=1S/C16H19BrN2O/c1-10(2)7-15(18)16(20)19-14-6-4-11-8-13(17)5-3-12(11)9-14/h3-6,8-10,15H,7,18H2,1-2H3,(H,19,20)/t15-/m1/s1
InChIKeyOZSIXUCSVFUPLK-OAHLLOKOSA-N
MW335.25 g/mol
LogP3.91
Rot. Bonds4

About (2R)-2-amino-N-(6-bromonaphthalen-2-yl)-4-methylpentanamide

(2R)-2-amino-N-(6-bromonaphthalen-2-yl)-4-methylpentanamide (PubChem CID 104903779) has the molecular formula C16H19BrN2O and a molecular weight of 335.25 g/mol. Its IUPAC name is (2R)-2-amino-N-(6-bromonaphthalen-2-yl)-4-methylpentanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-(6-bromonaphthalen-2-yl)-4-methylpentanamide
PubChem CID104903779
Molecular FormulaC16H19BrN2O
Molecular Weight335.25 g/mol
Exact Mass334.07
IUPAC Name(2R)-2-amino-N-(6-bromonaphthalen-2-yl)-4-methylpentanamide
SMILESCC(C)C[C@@H](N)C(=O)Nc1ccc2cc(Br)ccc2c1
InChIInChI=1S/C16H19BrN2O/c1-10(2)7-15(18)16(20)19-14-6-4-11-8-13(17)5-3-12(11)9-14/h3-6,8-10,15H,7,18H2,1-2H3,(H,19,20)/t15-/m1/s1
InChIKeyOZSIXUCSVFUPLK-OAHLLOKOSA-N
XLogP3.91
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.25
LogP ≤ 53.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-4-methyl-N-naphthalen-2-ylpentanamide chloride
CID 5351894
2-(aminomethyl)-N-(6-bromonaphthalen-2-yl)-4-methylpentanamide
CID 81266386
(2S)-2-amino-N-(6-bromonaphthalen-2-yl)-4-methylsulfanylbutanamide
CID 81259945
2-amino-N-(3,5-dibromo-4-hydroxyphenyl)-4-methylpentanamide
CID 13419970
N-(6-bromonaphthalen-2-yl)-3-methylbutanamide
CID 81259381
2-amino-N-(5-bromo-2-methylphenyl)-4-methylpentanamide
CID 43712543
(2R)-2-amino-N-(1-benzothiophen-5-yl)-4-methylpentanamide
CID 104902766
(2S)-2-amino-N-(1-benzothiophen-5-yl)-4-methylpentanamide
CID 61179447
2-bromo-N-(6-bromonaphthalen-2-yl)butanamide
CID 81260484
(2S)-2-amino-4-methyl-N-(3-methylphenyl)pentanamide
CID 22691033
2-amino-N-(4-hydroxyphenyl)-4-methylpentanamide
CID 22768242
(2R)-2-amino-N-(3-hydroxy-4-methylphenyl)-4-methylpentanamide
CID 107701657

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-(6-bromonaphthalen-2-yl)-4-methylpentanamide?
The IUPAC name of (2R)-2-amino-N-(6-bromonaphthalen-2-yl)-4-methylpentanamide (CID 104903779) is (2R)-2-amino-N-(6-bromonaphthalen-2-yl)-4-methylpentanamide.
What is the SMILES notation for (2R)-2-amino-N-(6-bromonaphthalen-2-yl)-4-methylpentanamide?
The canonical SMILES for (2R)-2-amino-N-(6-bromonaphthalen-2-yl)-4-methylpentanamide is CC(C)C[C@@H](N)C(=O)Nc1ccc2cc(Br)ccc2c1.
What is the InChIKey of (2R)-2-amino-N-(6-bromonaphthalen-2-yl)-4-methylpentanamide?
The InChIKey is OZSIXUCSVFUPLK-OAHLLOKOSA-N. The full InChI is InChI=1S/C16H19BrN2O/c1-10(2)7-15(18)16(20)19-14-6-4-11-8-13(17)5-3-12(11)9-14/h3-6,8-10,15H,7,18H2,1-2H3,(H,19,20)/t15-/m1/s1.
What are the key properties of (2R)-2-amino-N-(6-bromonaphthalen-2-yl)-4-methylpentanamide?
(2R)-2-amino-N-(6-bromonaphthalen-2-yl)-4-methylpentanamide has a molecular weight of 335.25 g/mol, XLogP of 3.91, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-(6-bromonaphthalen-2-yl)-4-methylpentanamide is sourced from PubChem (CID 104903779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).