1-(methoxymethyl)-N-methyl-N-[(1-propan-2-ylpyrazol-4-yl)methyl]cyclobutane-1-carboxamide

C15H25N3O2 — CID 74231830

IUPAC1-(methoxymethyl)-N-methyl-N-[(1-propan-2-ylpyrazol-4-yl)methyl]cyclobutane-1-carboxamide
SMILESCOCC1(C(=O)N(C)Cc2cnn(C(C)C)c2)CCC1
InChIInChI=1S/C15H25N3O2/c1-12(2)18-10-13(8-16-18)9-17(3)14(19)15(11-20-4)6-5-7-15/h8,10,12H,5-7,9,11H2,1-4H3
InChIKeyDOEIBLQXXQXKSH-UHFFFAOYSA-N
MW279.38 g/mol
LogP2.24
Rot. Bonds6

About 1-(methoxymethyl)-N-methyl-N-[(1-propan-2-ylpyrazol-4-yl)methyl]cyclobutane-1-carboxamide

1-(methoxymethyl)-N-methyl-N-[(1-propan-2-ylpyrazol-4-yl)methyl]cyclobutane-1-carboxamide (PubChem CID 74231830) has the molecular formula C15H25N3O2 and a molecular weight of 279.38 g/mol. Its IUPAC name is 1-(methoxymethyl)-N-methyl-N-[(1-propan-2-ylpyrazol-4-yl)methyl]cyclobutane-1-carboxamide.

Molecular Properties

Compound Name1-(methoxymethyl)-N-methyl-N-[(1-propan-2-ylpyrazol-4-yl)methyl]cyclobutane-1-carboxamide
PubChem CID74231830
Molecular FormulaC15H25N3O2
Molecular Weight279.38 g/mol
Exact Mass279.19
IUPAC Name1-(methoxymethyl)-N-methyl-N-[(1-propan-2-ylpyrazol-4-yl)methyl]cyclobutane-1-carboxamide
SMILESCOCC1(C(=O)N(C)Cc2cnn(C(C)C)c2)CCC1
InChIInChI=1S/C15H25N3O2/c1-12(2)18-10-13(8-16-18)9-17(3)14(19)15(11-20-4)6-5-7-15/h8,10,12H,5-7,9,11H2,1-4H3
InChIKeyDOEIBLQXXQXKSH-UHFFFAOYSA-N
XLogP2.24
TPSA47.36 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.38
LogP ≤ 52.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1-(methoxymethyl)-N-methyl-N-[(1-propan-2-ylpyrazol-4-yl)methyl]cyclobutane-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

Frequently Asked Questions

What is the IUPAC name of 1-(methoxymethyl)-N-methyl-N-[(1-propan-2-ylpyrazol-4-yl)methyl]cyclobutane-1-carboxamide?
The IUPAC name of 1-(methoxymethyl)-N-methyl-N-[(1-propan-2-ylpyrazol-4-yl)methyl]cyclobutane-1-carboxamide (CID 74231830) is 1-(methoxymethyl)-N-methyl-N-[(1-propan-2-ylpyrazol-4-yl)methyl]cyclobutane-1-carboxamide.
What is the SMILES notation for 1-(methoxymethyl)-N-methyl-N-[(1-propan-2-ylpyrazol-4-yl)methyl]cyclobutane-1-carboxamide?
The canonical SMILES for 1-(methoxymethyl)-N-methyl-N-[(1-propan-2-ylpyrazol-4-yl)methyl]cyclobutane-1-carboxamide is COCC1(C(=O)N(C)Cc2cnn(C(C)C)c2)CCC1.
What is the InChIKey of 1-(methoxymethyl)-N-methyl-N-[(1-propan-2-ylpyrazol-4-yl)methyl]cyclobutane-1-carboxamide?
The InChIKey is DOEIBLQXXQXKSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O2/c1-12(2)18-10-13(8-16-18)9-17(3)14(19)15(11-20-4)6-5-7-15/h8,10,12H,5-7,9,11H2,1-4H3.
What are the key properties of 1-(methoxymethyl)-N-methyl-N-[(1-propan-2-ylpyrazol-4-yl)methyl]cyclobutane-1-carboxamide?
1-(methoxymethyl)-N-methyl-N-[(1-propan-2-ylpyrazol-4-yl)methyl]cyclobutane-1-carboxamide has a molecular weight of 279.38 g/mol, XLogP of 2.24, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(methoxymethyl)-N-methyl-N-[(1-propan-2-ylpyrazol-4-yl)methyl]cyclobutane-1-carboxamide is sourced from PubChem (CID 74231830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).