N-[(2R)-1-pyrazol-1-ylpropan-2-yl]azetidine-1-carboxamide

C10H16N4O — CID 94031085

IUPACN-[(2R)-1-pyrazol-1-ylpropan-2-yl]azetidine-1-carboxamide
SMILESC[C@H](Cn1cccn1)NC(=O)N1CCC1
InChIInChI=1S/C10H16N4O/c1-9(8-14-7-2-4-11-14)12-10(15)13-5-3-6-13/h2,4,7,9H,3,5-6,8H2,1H3,(H,12,15)/t9-/m1/s1
InChIKeyAOYNHCVZOQBMAV-SECBINFHSA-N
MW208.26 g/mol
LogP0.69
Rot. Bonds3

About N-[(2R)-1-pyrazol-1-ylpropan-2-yl]azetidine-1-carboxamide

N-[(2R)-1-pyrazol-1-ylpropan-2-yl]azetidine-1-carboxamide (PubChem CID 94031085) has the molecular formula C10H16N4O and a molecular weight of 208.26 g/mol. Its IUPAC name is N-[(2R)-1-pyrazol-1-ylpropan-2-yl]azetidine-1-carboxamide.

Molecular Properties

Compound NameN-[(2R)-1-pyrazol-1-ylpropan-2-yl]azetidine-1-carboxamide
PubChem CID94031085
Molecular FormulaC10H16N4O
Molecular Weight208.26 g/mol
Exact Mass208.13
IUPAC NameN-[(2R)-1-pyrazol-1-ylpropan-2-yl]azetidine-1-carboxamide
SMILESC[C@H](Cn1cccn1)NC(=O)N1CCC1
InChIInChI=1S/C10H16N4O/c1-9(8-14-7-2-4-11-14)12-10(15)13-5-3-6-13/h2,4,7,9H,3,5-6,8H2,1H3,(H,12,15)/t9-/m1/s1
InChIKeyAOYNHCVZOQBMAV-SECBINFHSA-N
XLogP0.69
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 50.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-Isopropyl-1H-pyrazole-1-carboxamide
CID 44306378
1-Methyl-1-[(1-methylpyrazol-4-yl)methyl]-3-(1-pyrazol-1-ylpropan-2-yl)urea
CID 45831715
1-(2-Methyl-2-piperidin-1-ylpropyl)-3-(2-methyl-3-pyrazol-1-ylpropyl)urea
CID 47069469
1-[2-(4-Ethylpiperazin-1-yl)propyl]-3-(1-ethylpyrazol-4-yl)urea
CID 53502914
1-(1-Ethylpyrazol-4-yl)-3-(2-pyrrolidin-1-ylpropyl)urea
CID 53504548
4-(2-methoxyethyl)-N-(1-pyrazol-1-ylpropan-2-yl)-1,4-diazepane-1-carboxamide
CID 53504787
1-[2-(Dimethylamino)propyl]-3-(1-ethylpyrazol-4-yl)urea
CID 53504812
1-(1-Ethylpyrazol-4-yl)-3-(2-pyrrolidin-1-ylbutyl)urea
CID 53506142
1-[2-[Cyclopropyl(methyl)amino]propyl]-3-(1-ethylpyrazol-4-yl)urea
CID 53595544
N-(2-cyanoethyl)-2-(3-pyrazol-1-ylazetidin-1-yl)acetamide
CID 56781223
4-acetyl-N-(1-pyrazol-1-ylpropan-2-yl)-1,4-diazepane-1-carboxamide
CID 71893140
1-(1-Pyrazol-1-ylpropan-2-yl)-3-(2,2,2-trifluoroethyl)urea
CID 47227722

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-1-pyrazol-1-ylpropan-2-yl]azetidine-1-carboxamide?
The IUPAC name of N-[(2R)-1-pyrazol-1-ylpropan-2-yl]azetidine-1-carboxamide (CID 94031085) is N-[(2R)-1-pyrazol-1-ylpropan-2-yl]azetidine-1-carboxamide.
What is the SMILES notation for N-[(2R)-1-pyrazol-1-ylpropan-2-yl]azetidine-1-carboxamide?
The canonical SMILES for N-[(2R)-1-pyrazol-1-ylpropan-2-yl]azetidine-1-carboxamide is C[C@H](Cn1cccn1)NC(=O)N1CCC1.
What is the InChIKey of N-[(2R)-1-pyrazol-1-ylpropan-2-yl]azetidine-1-carboxamide?
The InChIKey is AOYNHCVZOQBMAV-SECBINFHSA-N. The full InChI is InChI=1S/C10H16N4O/c1-9(8-14-7-2-4-11-14)12-10(15)13-5-3-6-13/h2,4,7,9H,3,5-6,8H2,1H3,(H,12,15)/t9-/m1/s1.
What are the key properties of N-[(2R)-1-pyrazol-1-ylpropan-2-yl]azetidine-1-carboxamide?
N-[(2R)-1-pyrazol-1-ylpropan-2-yl]azetidine-1-carboxamide has a molecular weight of 208.26 g/mol, XLogP of 0.69, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-1-pyrazol-1-ylpropan-2-yl]azetidine-1-carboxamide is sourced from PubChem (CID 94031085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).