1,1-dimethyl-3-[[5-[(1-propan-2-ylpiperidin-4-yl)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl]methyl]urea

C19H34N6O — CID 70767206

IUPAC1,1-dimethyl-3-[[5-[(1-propan-2-ylpiperidin-4-yl)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl]methyl]urea
SMILESCC(C)N1CCC(CN2CCn3nc(CNC(=O)N(C)C)cc3C2)CC1
InChIInChI=1S/C19H34N6O/c1-15(2)24-7-5-16(6-8-24)13-23-9-10-25-18(14-23)11-17(21-25)12-20-19(26)22(3)4/h11,15-16H,5-10,12-14H2,1-4H3,(H,20,26)
InChIKeyWWYIQSXDTGJDPL-UHFFFAOYSA-N
MW362.52 g/mol
LogP1.59
Rot. Bonds5

About 1,1-dimethyl-3-[[5-[(1-propan-2-ylpiperidin-4-yl)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl]methyl]urea

1,1-dimethyl-3-[[5-[(1-propan-2-ylpiperidin-4-yl)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl]methyl]urea (PubChem CID 70767206) has the molecular formula C19H34N6O and a molecular weight of 362.52 g/mol. Its IUPAC name is 1,1-dimethyl-3-[[5-[(1-propan-2-ylpiperidin-4-yl)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl]methyl]urea.

Molecular Properties

Compound Name1,1-dimethyl-3-[[5-[(1-propan-2-ylpiperidin-4-yl)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl]methyl]urea
PubChem CID70767206
Molecular FormulaC19H34N6O
Molecular Weight362.52 g/mol
Exact Mass362.28
IUPAC Name1,1-dimethyl-3-[[5-[(1-propan-2-ylpiperidin-4-yl)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl]methyl]urea
SMILESCC(C)N1CCC(CN2CCn3nc(CNC(=O)N(C)C)cc3C2)CC1
InChIInChI=1S/C19H34N6O/c1-15(2)24-7-5-16(6-8-24)13-23-9-10-25-18(14-23)11-17(21-25)12-20-19(26)22(3)4/h11,15-16H,5-10,12-14H2,1-4H3,(H,20,26)
InChIKeyWWYIQSXDTGJDPL-UHFFFAOYSA-N
XLogP1.59
TPSA56.64 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.52
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1,1-dimethyl-3-[[5-[(1-propan-2-ylpiperidin-4-yl)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl]methyl]urea 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 1,1-dimethyl-3-[[5-[(1-propan-2-ylpiperidin-4-yl)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl]methyl]urea?
The IUPAC name of 1,1-dimethyl-3-[[5-[(1-propan-2-ylpiperidin-4-yl)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl]methyl]urea (CID 70767206) is 1,1-dimethyl-3-[[5-[(1-propan-2-ylpiperidin-4-yl)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl]methyl]urea.
What is the SMILES notation for 1,1-dimethyl-3-[[5-[(1-propan-2-ylpiperidin-4-yl)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl]methyl]urea?
The canonical SMILES for 1,1-dimethyl-3-[[5-[(1-propan-2-ylpiperidin-4-yl)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl]methyl]urea is CC(C)N1CCC(CN2CCn3nc(CNC(=O)N(C)C)cc3C2)CC1.
What is the InChIKey of 1,1-dimethyl-3-[[5-[(1-propan-2-ylpiperidin-4-yl)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl]methyl]urea?
The InChIKey is WWYIQSXDTGJDPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H34N6O/c1-15(2)24-7-5-16(6-8-24)13-23-9-10-25-18(14-23)11-17(21-25)12-20-19(26)22(3)4/h11,15-16H,5-10,12-14H2,1-4H3,(H,20,26).
What are the key properties of 1,1-dimethyl-3-[[5-[(1-propan-2-ylpiperidin-4-yl)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl]methyl]urea?
1,1-dimethyl-3-[[5-[(1-propan-2-ylpiperidin-4-yl)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl]methyl]urea has a molecular weight of 362.52 g/mol, XLogP of 1.59, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-dimethyl-3-[[5-[(1-propan-2-ylpiperidin-4-yl)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl]methyl]urea is sourced from PubChem (CID 70767206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).