2-amino-N-[3-(5-methyltetrazol-1-yl)phenyl]hexanamide

C14H20N6O — CID 60854574

IUPAC2-amino-N-[3-(5-methyltetrazol-1-yl)phenyl]hexanamide
SMILESCCCCC(N)C(=O)Nc1cccc(-n2nnnc2C)c1
InChIInChI=1S/C14H20N6O/c1-3-4-8-13(15)14(21)16-11-6-5-7-12(9-11)20-10(2)17-18-19-20/h5-7,9,13H,3-4,8,15H2,1-2H3,(H,16,21)
InChIKeyORZPLJGGDIYEHL-UHFFFAOYSA-N
MW288.36 g/mol
LogP1.43
Rot. Bonds6

About 2-amino-N-[3-(5-methyltetrazol-1-yl)phenyl]hexanamide

2-amino-N-[3-(5-methyltetrazol-1-yl)phenyl]hexanamide (PubChem CID 60854574) has the molecular formula C14H20N6O and a molecular weight of 288.36 g/mol. Its IUPAC name is 2-amino-N-[3-(5-methyltetrazol-1-yl)phenyl]hexanamide.

Molecular Properties

Compound Name2-amino-N-[3-(5-methyltetrazol-1-yl)phenyl]hexanamide
PubChem CID60854574
Molecular FormulaC14H20N6O
Molecular Weight288.36 g/mol
Exact Mass288.17
IUPAC Name2-amino-N-[3-(5-methyltetrazol-1-yl)phenyl]hexanamide
SMILESCCCCC(N)C(=O)Nc1cccc(-n2nnnc2C)c1
InChIInChI=1S/C14H20N6O/c1-3-4-8-13(15)14(21)16-11-6-5-7-12(9-11)20-10(2)17-18-19-20/h5-7,9,13H,3-4,8,15H2,1-2H3,(H,16,21)
InChIKeyORZPLJGGDIYEHL-UHFFFAOYSA-N
XLogP1.43
TPSA98.72 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.36
LogP ≤ 51.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

(2R)-2-amino-4-methyl-N-[3-(5-methyltetrazol-1-yl)phenyl]pentanamide
CID 104902927
2-(aminomethyl)-N-[3-(5-methyltetrazol-1-yl)phenyl]pentanamide
CID 65230278
2-amino-3-methyl-N-[3-(5-methyltetrazol-1-yl)phenyl]pentanamide
CID 43713354
(2S)-2-amino-3-methyl-N-[3-(5-methyltetrazol-1-yl)phenyl]butanamide
CID 61178099
5-amino-2-methyl-N-[3-(5-methyltetrazol-1-yl)phenyl]pentanamide
CID 104684147
(2S)-2-amino-N-[3-(1-methyltetrazol-5-yl)phenyl]hexanamide
CID 103831156
2-amino-N-[3-(1-methyltetrazol-5-yl)phenyl]hexanamide
CID 60853677
4-amino-N-[3-(5-methyltetrazol-1-yl)phenyl]pentanamide;hydrochloride
CID 120560652
2-methylsulfanyl-N-[3-(5-methyltetrazol-1-yl)phenyl]propanamide
CID 47329361
2-hydroxy-N-[3-(5-methyltetrazol-1-yl)phenyl]-2-phenylacetamide
CID 111432358
2-amino-N-(3-imidazol-1-ylphenyl)hexanamide
CID 60853484
N-(3-acetamidophenyl)-2-aminohexanamide
CID 60852572

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[3-(5-methyltetrazol-1-yl)phenyl]hexanamide?
The IUPAC name of 2-amino-N-[3-(5-methyltetrazol-1-yl)phenyl]hexanamide (CID 60854574) is 2-amino-N-[3-(5-methyltetrazol-1-yl)phenyl]hexanamide.
What is the SMILES notation for 2-amino-N-[3-(5-methyltetrazol-1-yl)phenyl]hexanamide?
The canonical SMILES for 2-amino-N-[3-(5-methyltetrazol-1-yl)phenyl]hexanamide is CCCCC(N)C(=O)Nc1cccc(-n2nnnc2C)c1.
What is the InChIKey of 2-amino-N-[3-(5-methyltetrazol-1-yl)phenyl]hexanamide?
The InChIKey is ORZPLJGGDIYEHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N6O/c1-3-4-8-13(15)14(21)16-11-6-5-7-12(9-11)20-10(2)17-18-19-20/h5-7,9,13H,3-4,8,15H2,1-2H3,(H,16,21).
What are the key properties of 2-amino-N-[3-(5-methyltetrazol-1-yl)phenyl]hexanamide?
2-amino-N-[3-(5-methyltetrazol-1-yl)phenyl]hexanamide has a molecular weight of 288.36 g/mol, XLogP of 1.43, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[3-(5-methyltetrazol-1-yl)phenyl]hexanamide is sourced from PubChem (CID 60854574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).