1-ethyl-N-[(3-hydroxy-2-methyloxolan-3-yl)methyl]-3-propan-2-ylpyrazole-5-carboxamide

C15H25N3O3 — CID 107301962

IUPAC1-ethyl-N-[(3-hydroxy-2-methyloxolan-3-yl)methyl]-3-propan-2-ylpyrazole-5-carboxamide
SMILESCCn1nc(C(C)C)cc1C(=O)NCC1(O)CCOC1C
InChIInChI=1S/C15H25N3O3/c1-5-18-13(8-12(17-18)10(2)3)14(19)16-9-15(20)6-7-21-11(15)4/h8,10-11,20H,5-7,9H2,1-4H3,(H,16,19)
InChIKeyZSWJXBXUEIIMJZ-UHFFFAOYSA-N
MW295.38 g/mol
LogP1.30
Rot. Bonds5

About 1-ethyl-N-[(3-hydroxy-2-methyloxolan-3-yl)methyl]-3-propan-2-ylpyrazole-5-carboxamide

1-ethyl-N-[(3-hydroxy-2-methyloxolan-3-yl)methyl]-3-propan-2-ylpyrazole-5-carboxamide (PubChem CID 107301962) has the molecular formula C15H25N3O3 and a molecular weight of 295.38 g/mol. Its IUPAC name is 1-ethyl-N-[(3-hydroxy-2-methyloxolan-3-yl)methyl]-3-propan-2-ylpyrazole-5-carboxamide.

Molecular Properties

Compound Name1-ethyl-N-[(3-hydroxy-2-methyloxolan-3-yl)methyl]-3-propan-2-ylpyrazole-5-carboxamide
PubChem CID107301962
Molecular FormulaC15H25N3O3
Molecular Weight295.38 g/mol
Exact Mass295.19
IUPAC Name1-ethyl-N-[(3-hydroxy-2-methyloxolan-3-yl)methyl]-3-propan-2-ylpyrazole-5-carboxamide
SMILESCCn1nc(C(C)C)cc1C(=O)NCC1(O)CCOC1C
InChIInChI=1S/C15H25N3O3/c1-5-18-13(8-12(17-18)10(2)3)14(19)16-9-15(20)6-7-21-11(15)4/h8,10-11,20H,5-7,9H2,1-4H3,(H,16,19)
InChIKeyZSWJXBXUEIIMJZ-UHFFFAOYSA-N
XLogP1.30
TPSA76.38 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.38
LogP ≤ 51.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 1-ethyl-N-[(3-hydroxy-2-methyloxolan-3-yl)methyl]-3-propan-2-ylpyrazole-5-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

4-amino-N-[(3-hydroxy-2-methyloxolan-3-yl)methyl]-1-propan-2-ylpyrrole-2-carboxamide
CID 106099117
1-[[(1-ethyl-3-propan-2-ylpyrazole-5-carbonyl)amino]methyl]cyclopropane-1-carboxylic acid
CID 115449376
3,5-difluoro-N-[(3-hydroxy-2-methyloxolan-3-yl)methyl]benzamide
CID 107302216
3-bromo-N-[(3-hydroxy-2-methyloxolan-3-yl)methyl]-5-methylbenzamide
CID 107302290
4-N-[(3-hydroxy-2-methyloxolan-3-yl)methyl]benzene-1,4-dicarboxamide
CID 107302150
N-(3-amino-2-hydroxy-3-oxopropyl)-1-ethyl-3-propan-2-ylpyrazole-5-carboxamide
CID 106164346
N-[(3-hydroxy-2-methyloxolan-3-yl)methyl]-4-methylbenzamide
CID 107302098
N-[(3-hydroxy-2-methyloxolan-3-yl)methyl]-4-propan-2-yloxybenzamide
CID 107302261
ethane;1-ethyl-N-methyl-3-propan-2-ylpyrazole-5-carboxamide
CID 176998703
1-ethyl-N-(2-hydroxy-2-methylpropyl)-3-propan-2-ylpyrazole-5-carboxamide
CID 65109682
4-tert-butyl-N-[(3-hydroxy-2-methyloxolan-3-yl)methyl]benzamide
CID 107301763
N-(2,3-dihydroxy-2-methylpropyl)-1-ethyl-3-propan-2-ylpyrazole-5-carboxamide
CID 66171515

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-N-[(3-hydroxy-2-methyloxolan-3-yl)methyl]-3-propan-2-ylpyrazole-5-carboxamide?
The IUPAC name of 1-ethyl-N-[(3-hydroxy-2-methyloxolan-3-yl)methyl]-3-propan-2-ylpyrazole-5-carboxamide (CID 107301962) is 1-ethyl-N-[(3-hydroxy-2-methyloxolan-3-yl)methyl]-3-propan-2-ylpyrazole-5-carboxamide.
What is the SMILES notation for 1-ethyl-N-[(3-hydroxy-2-methyloxolan-3-yl)methyl]-3-propan-2-ylpyrazole-5-carboxamide?
The canonical SMILES for 1-ethyl-N-[(3-hydroxy-2-methyloxolan-3-yl)methyl]-3-propan-2-ylpyrazole-5-carboxamide is CCn1nc(C(C)C)cc1C(=O)NCC1(O)CCOC1C.
What is the InChIKey of 1-ethyl-N-[(3-hydroxy-2-methyloxolan-3-yl)methyl]-3-propan-2-ylpyrazole-5-carboxamide?
The InChIKey is ZSWJXBXUEIIMJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O3/c1-5-18-13(8-12(17-18)10(2)3)14(19)16-9-15(20)6-7-21-11(15)4/h8,10-11,20H,5-7,9H2,1-4H3,(H,16,19).
What are the key properties of 1-ethyl-N-[(3-hydroxy-2-methyloxolan-3-yl)methyl]-3-propan-2-ylpyrazole-5-carboxamide?
1-ethyl-N-[(3-hydroxy-2-methyloxolan-3-yl)methyl]-3-propan-2-ylpyrazole-5-carboxamide has a molecular weight of 295.38 g/mol, XLogP of 1.30, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-N-[(3-hydroxy-2-methyloxolan-3-yl)methyl]-3-propan-2-ylpyrazole-5-carboxamide is sourced from PubChem (CID 107301962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).