2-amino-2-(oxan-4-yl)-N-[3-(tetrazol-1-yl)phenyl]acetamide

C14H18N6O2 — CID 120784046

IUPAC2-amino-2-(oxan-4-yl)-N-[3-(tetrazol-1-yl)phenyl]acetamide
SMILESNC(C(=O)Nc1cccc(-n2cnnn2)c1)C1CCOCC1
InChIInChI=1S/C14H18N6O2/c15-13(10-4-6-22-7-5-10)14(21)17-11-2-1-3-12(8-11)20-9-16-18-19-20/h1-3,8-10,13H,4-7,15H2,(H,17,21)
InChIKeyRILUHVZRIFGLQT-UHFFFAOYSA-N
MW302.34 g/mol
LogP0.35
Rot. Bonds4

About 2-amino-2-(oxan-4-yl)-N-[3-(tetrazol-1-yl)phenyl]acetamide

2-amino-2-(oxan-4-yl)-N-[3-(tetrazol-1-yl)phenyl]acetamide (PubChem CID 120784046) has the molecular formula C14H18N6O2 and a molecular weight of 302.34 g/mol. Its IUPAC name is 2-amino-2-(oxan-4-yl)-N-[3-(tetrazol-1-yl)phenyl]acetamide.

Molecular Properties

Compound Name2-amino-2-(oxan-4-yl)-N-[3-(tetrazol-1-yl)phenyl]acetamide
PubChem CID120784046
Molecular FormulaC14H18N6O2
Molecular Weight302.34 g/mol
Exact Mass302.15
IUPAC Name2-amino-2-(oxan-4-yl)-N-[3-(tetrazol-1-yl)phenyl]acetamide
SMILESNC(C(=O)Nc1cccc(-n2cnnn2)c1)C1CCOCC1
InChIInChI=1S/C14H18N6O2/c15-13(10-4-6-22-7-5-10)14(21)17-11-2-1-3-12(8-11)20-9-16-18-19-20/h1-3,8-10,13H,4-7,15H2,(H,17,21)
InChIKeyRILUHVZRIFGLQT-UHFFFAOYSA-N
XLogP0.35
TPSA107.95 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.34
LogP ≤ 50.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

(2R)-2-amino-N-[3-(tetrazol-1-yl)phenyl]propanamide
CID 54991235
2,2-diphenyl-N-[3-(tetrazol-1-yl)phenyl]acetamide
CID 7694180
N-[3-(tetrazol-1-yl)phenyl]oxan-4-amine
CID 43683923
2-ethyl-N-[3-(tetrazol-1-yl)phenyl]butanamide
CID 47097708
2-amino-N-(3-chlorophenyl)-2-(oxan-4-yl)acetamide
CID 120782718
2-amino-N-(3-methylphenyl)-2-(oxan-4-yl)acetamide
CID 120782660
N-(3-acetamidophenyl)-2-amino-2-(oxan-4-yl)acetamide;hydrochloride
CID 120782773
(3S)-1-(oxan-4-yl)-N-[3-(tetrazol-1-yl)phenyl]piperidine-3-carboxamide
CID 25371663
2-amino-2-(oxan-4-yl)-N-[3-(2-oxo-1,3-diazinan-1-yl)phenyl]acetamide
CID 120795442
2-amino-2-(oxan-4-yl)-N-(3-propan-2-ylphenyl)acetamide
CID 120784140
4-amino-N-[3-(tetrazol-1-yl)phenyl]benzamide
CID 43702822
N-[3-(tetrazol-1-yl)phenyl]piperidine-4-carboxamide
CID 43702817

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-(oxan-4-yl)-N-[3-(tetrazol-1-yl)phenyl]acetamide?
The IUPAC name of 2-amino-2-(oxan-4-yl)-N-[3-(tetrazol-1-yl)phenyl]acetamide (CID 120784046) is 2-amino-2-(oxan-4-yl)-N-[3-(tetrazol-1-yl)phenyl]acetamide.
What is the SMILES notation for 2-amino-2-(oxan-4-yl)-N-[3-(tetrazol-1-yl)phenyl]acetamide?
The canonical SMILES for 2-amino-2-(oxan-4-yl)-N-[3-(tetrazol-1-yl)phenyl]acetamide is NC(C(=O)Nc1cccc(-n2cnnn2)c1)C1CCOCC1.
What is the InChIKey of 2-amino-2-(oxan-4-yl)-N-[3-(tetrazol-1-yl)phenyl]acetamide?
The InChIKey is RILUHVZRIFGLQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N6O2/c15-13(10-4-6-22-7-5-10)14(21)17-11-2-1-3-12(8-11)20-9-16-18-19-20/h1-3,8-10,13H,4-7,15H2,(H,17,21).
What are the key properties of 2-amino-2-(oxan-4-yl)-N-[3-(tetrazol-1-yl)phenyl]acetamide?
2-amino-2-(oxan-4-yl)-N-[3-(tetrazol-1-yl)phenyl]acetamide has a molecular weight of 302.34 g/mol, XLogP of 0.35, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-(oxan-4-yl)-N-[3-(tetrazol-1-yl)phenyl]acetamide is sourced from PubChem (CID 120784046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).