(2R)-2-(dimethylamino)-2-(4-fluorophenyl)-N-[3-(5-methyltetrazol-1-yl)phenyl]acetamide

C18H19FN6O — CID 92613812

IUPAC(2R)-2-(dimethylamino)-2-(4-fluorophenyl)-N-[3-(5-methyltetrazol-1-yl)phenyl]acetamide
SMILESCc1nnnn1-c1cccc(NC(=O)[C@@H](c2ccc(F)cc2)N(C)C)c1
InChIInChI=1S/C18H19FN6O/c1-12-21-22-23-25(12)16-6-4-5-15(11-16)20-18(26)17(24(2)3)13-7-9-14(19)10-8-13/h4-11,17H,1-3H3,(H,20,26)/t17-/m1/s1
InChIKeyGEVBCMBDYNGORU-QGZVFWFLSA-N
MW354.39 g/mol
LogP2.35
Rot. Bonds5

About (2R)-2-(dimethylamino)-2-(4-fluorophenyl)-N-[3-(5-methyltetrazol-1-yl)phenyl]acetamide

(2R)-2-(dimethylamino)-2-(4-fluorophenyl)-N-[3-(5-methyltetrazol-1-yl)phenyl]acetamide (PubChem CID 92613812) has the molecular formula C18H19FN6O and a molecular weight of 354.39 g/mol. Its IUPAC name is (2R)-2-(dimethylamino)-2-(4-fluorophenyl)-N-[3-(5-methyltetrazol-1-yl)phenyl]acetamide.

Molecular Properties

Compound Name(2R)-2-(dimethylamino)-2-(4-fluorophenyl)-N-[3-(5-methyltetrazol-1-yl)phenyl]acetamide
PubChem CID92613812
Molecular FormulaC18H19FN6O
Molecular Weight354.39 g/mol
Exact Mass354.16
IUPAC Name(2R)-2-(dimethylamino)-2-(4-fluorophenyl)-N-[3-(5-methyltetrazol-1-yl)phenyl]acetamide
SMILESCc1nnnn1-c1cccc(NC(=O)[C@@H](c2ccc(F)cc2)N(C)C)c1
InChIInChI=1S/C18H19FN6O/c1-12-21-22-23-25(12)16-6-4-5-15(11-16)20-18(26)17(24(2)3)13-7-9-14(19)10-8-13/h4-11,17H,1-3H3,(H,20,26)/t17-/m1/s1
InChIKeyGEVBCMBDYNGORU-QGZVFWFLSA-N
XLogP2.35
TPSA75.94 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.39
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze (2R)-2-(dimethylamino)-2-(4-fluorophenyl)-N-[3-(5-methyltetrazol-1-yl)phenyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-hydroxy-N-[3-(5-methyltetrazol-1-yl)phenyl]-2-phenylacetamide
CID 111432358
(2S)-2-amino-3-methyl-N-[3-(5-methyltetrazol-1-yl)phenyl]butanamide
CID 61178099
2-methylsulfanyl-N-[3-(5-methyltetrazol-1-yl)phenyl]propanamide
CID 47329361
1-[2-(4-fluorophenoxy)ethyl]-1-methyl-3-[3-(5-methyltetrazol-1-yl)phenyl]urea
CID 55698026
(2R)-2-amino-4-methyl-N-[3-(5-methyltetrazol-1-yl)phenyl]pentanamide
CID 104902927
1-[(3-fluorophenyl)methyl]-1-methyl-3-[3-(5-methyltetrazol-1-yl)phenyl]urea
CID 86988801
2-amino-3-methyl-N-[3-(5-methyltetrazol-1-yl)phenyl]pentanamide
CID 43713354
2-(aminomethyl)-N-[3-(5-methyltetrazol-1-yl)phenyl]pentanamide
CID 65230278
5-amino-2-methyl-N-[3-(5-methyltetrazol-1-yl)phenyl]pentanamide
CID 104684147
2-amino-N-[3-(5-methyltetrazol-1-yl)phenyl]hexanamide
CID 60854574
(2S)-2-(benzenesulfonamido)-N-[3-(5-methyltetrazol-1-yl)phenyl]propanamide
CID 55939907
2-(4-fluorophenyl)-N-[3-(5-methyltetrazol-1-yl)phenyl]-1,3-thiazole-4-carboxamide
CID 86983157

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(dimethylamino)-2-(4-fluorophenyl)-N-[3-(5-methyltetrazol-1-yl)phenyl]acetamide?
The IUPAC name of (2R)-2-(dimethylamino)-2-(4-fluorophenyl)-N-[3-(5-methyltetrazol-1-yl)phenyl]acetamide (CID 92613812) is (2R)-2-(dimethylamino)-2-(4-fluorophenyl)-N-[3-(5-methyltetrazol-1-yl)phenyl]acetamide.
What is the SMILES notation for (2R)-2-(dimethylamino)-2-(4-fluorophenyl)-N-[3-(5-methyltetrazol-1-yl)phenyl]acetamide?
The canonical SMILES for (2R)-2-(dimethylamino)-2-(4-fluorophenyl)-N-[3-(5-methyltetrazol-1-yl)phenyl]acetamide is Cc1nnnn1-c1cccc(NC(=O)[C@@H](c2ccc(F)cc2)N(C)C)c1.
What is the InChIKey of (2R)-2-(dimethylamino)-2-(4-fluorophenyl)-N-[3-(5-methyltetrazol-1-yl)phenyl]acetamide?
The InChIKey is GEVBCMBDYNGORU-QGZVFWFLSA-N. The full InChI is InChI=1S/C18H19FN6O/c1-12-21-22-23-25(12)16-6-4-5-15(11-16)20-18(26)17(24(2)3)13-7-9-14(19)10-8-13/h4-11,17H,1-3H3,(H,20,26)/t17-/m1/s1.
What are the key properties of (2R)-2-(dimethylamino)-2-(4-fluorophenyl)-N-[3-(5-methyltetrazol-1-yl)phenyl]acetamide?
(2R)-2-(dimethylamino)-2-(4-fluorophenyl)-N-[3-(5-methyltetrazol-1-yl)phenyl]acetamide has a molecular weight of 354.39 g/mol, XLogP of 2.35, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(dimethylamino)-2-(4-fluorophenyl)-N-[3-(5-methyltetrazol-1-yl)phenyl]acetamide is sourced from PubChem (CID 92613812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).