N-(3-tert-butyl-1-methylpyrazol-5-yl)-2-(3-methoxyphenyl)azetidine-1-carboxamide

C19H26N4O2 — CID 118762203

IUPACN-(3-tert-butyl-1-methylpyrazol-5-yl)-2-(3-methoxyphenyl)azetidine-1-carboxamide
SMILESCOc1cccc(C2CCN2C(=O)Nc2cc(C(C)(C)C)nn2C)c1
InChIInChI=1S/C19H26N4O2/c1-19(2,3)16-12-17(22(4)21-16)20-18(24)23-10-9-15(23)13-7-6-8-14(11-13)25-5/h6-8,11-12,15H,9-10H2,1-5H3,(H,20,24)
InChIKeyRRTJWBHNGZFTQG-UHFFFAOYSA-N
MW342.44 g/mol
LogP3.71
Rot. Bonds3

About N-(3-tert-butyl-1-methylpyrazol-5-yl)-2-(3-methoxyphenyl)azetidine-1-carboxamide

N-(3-tert-butyl-1-methylpyrazol-5-yl)-2-(3-methoxyphenyl)azetidine-1-carboxamide (PubChem CID 118762203) has the molecular formula C19H26N4O2 and a molecular weight of 342.44 g/mol. Its IUPAC name is N-(3-tert-butyl-1-methylpyrazol-5-yl)-2-(3-methoxyphenyl)azetidine-1-carboxamide.

Molecular Properties

Compound NameN-(3-tert-butyl-1-methylpyrazol-5-yl)-2-(3-methoxyphenyl)azetidine-1-carboxamide
PubChem CID118762203
Molecular FormulaC19H26N4O2
Molecular Weight342.44 g/mol
Exact Mass342.21
IUPAC NameN-(3-tert-butyl-1-methylpyrazol-5-yl)-2-(3-methoxyphenyl)azetidine-1-carboxamide
SMILESCOc1cccc(C2CCN2C(=O)Nc2cc(C(C)(C)C)nn2C)c1
InChIInChI=1S/C19H26N4O2/c1-19(2,3)16-12-17(22(4)21-16)20-18(24)23-10-9-15(23)13-7-6-8-14(11-13)25-5/h6-8,11-12,15H,9-10H2,1-5H3,(H,20,24)
InChIKeyRRTJWBHNGZFTQG-UHFFFAOYSA-N
XLogP3.71
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.44
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(3-tert-butyl-1-methylpyrazol-5-yl)-2-(3-methoxyphenyl)azetidine-1-carboxamide 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

(2S)-N-(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)-2-(3-methoxyphenyl)azetidine-1-carboxamide
CID 126443661
N-[(1,3-dimethylpyrazol-4-yl)methyl]-2-(3-methoxyphenyl)azetidine-1-carboxamide
CID 119065873
N-[3-(dimethylamino)-2,2-dimethylpropyl]-2-(3-methoxyphenyl)azetidine-1-carboxamide
CID 119072220
(2S)-2-(3-methoxyphenyl)-N-[2-methyl-5-(2-methyltetrazol-5-yl)phenyl]azetidine-1-carboxamide
CID 126444127
bis[2-(3-methoxyphenyl)pyrrolidin-1-yl]methanone
CID 174863821
tert-butyl 2-(3-methoxyphenyl)pyrrolidine-1-carboxylate
CID 15189984
N-(3-ethyl-1-methylpyrazol-5-yl)-2-(4-methoxyphenyl)azepane-1-carboxamide
CID 139001901
N-(3-ethylphenyl)-2-(3-methoxyphenyl)pyrrolidine-1-carboxamide
CID 86987252
2-(3-methoxyphenyl)-N-(4-methyl-3-oxo-1,4-benzoxazin-6-yl)azetidine-1-carboxamide
CID 72855696
N-(3-bromophenyl)-2-(3-methoxyphenyl)pyrrolidine-1-carboxamide
CID 86986361
(2S)-N-(2-ethylsulfanylethyl)-2-(3-methoxyphenyl)azetidine-1-carboxamide
CID 126443026
2-(3-methoxyphenyl)-N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]azetidine-1-carboxamide
CID 74249571

Frequently Asked Questions

What is the IUPAC name of N-(3-tert-butyl-1-methylpyrazol-5-yl)-2-(3-methoxyphenyl)azetidine-1-carboxamide?
The IUPAC name of N-(3-tert-butyl-1-methylpyrazol-5-yl)-2-(3-methoxyphenyl)azetidine-1-carboxamide (CID 118762203) is N-(3-tert-butyl-1-methylpyrazol-5-yl)-2-(3-methoxyphenyl)azetidine-1-carboxamide.
What is the SMILES notation for N-(3-tert-butyl-1-methylpyrazol-5-yl)-2-(3-methoxyphenyl)azetidine-1-carboxamide?
The canonical SMILES for N-(3-tert-butyl-1-methylpyrazol-5-yl)-2-(3-methoxyphenyl)azetidine-1-carboxamide is COc1cccc(C2CCN2C(=O)Nc2cc(C(C)(C)C)nn2C)c1.
What is the InChIKey of N-(3-tert-butyl-1-methylpyrazol-5-yl)-2-(3-methoxyphenyl)azetidine-1-carboxamide?
The InChIKey is RRTJWBHNGZFTQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N4O2/c1-19(2,3)16-12-17(22(4)21-16)20-18(24)23-10-9-15(23)13-7-6-8-14(11-13)25-5/h6-8,11-12,15H,9-10H2,1-5H3,(H,20,24).
What are the key properties of N-(3-tert-butyl-1-methylpyrazol-5-yl)-2-(3-methoxyphenyl)azetidine-1-carboxamide?
N-(3-tert-butyl-1-methylpyrazol-5-yl)-2-(3-methoxyphenyl)azetidine-1-carboxamide has a molecular weight of 342.44 g/mol, XLogP of 3.71, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-tert-butyl-1-methylpyrazol-5-yl)-2-(3-methoxyphenyl)azetidine-1-carboxamide is sourced from PubChem (CID 118762203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).