4-(dimethylamino)-N-(2-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)benzamide

C16H20N4O — CID 30859118

IUPAC4-(dimethylamino)-N-(2-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)benzamide
SMILESCN(C)c1ccc(C(=O)Nc2c3c(nn2C)CCC3)cc1
InChIInChI=1S/C16H20N4O/c1-19(2)12-9-7-11(8-10-12)16(21)17-15-13-5-4-6-14(13)18-20(15)3/h7-10H,4-6H2,1-3H3,(H,17,21)
InChIKeyLLPYVSCDEOPSDN-UHFFFAOYSA-N
MW284.36 g/mol
LogP2.23
Rot. Bonds3

About 4-(dimethylamino)-N-(2-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)benzamide

4-(dimethylamino)-N-(2-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)benzamide (PubChem CID 30859118) has the molecular formula C16H20N4O and a molecular weight of 284.36 g/mol. Its IUPAC name is 4-(dimethylamino)-N-(2-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)benzamide.

Molecular Properties

Compound Name4-(dimethylamino)-N-(2-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)benzamide
PubChem CID30859118
Molecular FormulaC16H20N4O
Molecular Weight284.36 g/mol
Exact Mass284.16
IUPAC Name4-(dimethylamino)-N-(2-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)benzamide
SMILESCN(C)c1ccc(C(=O)Nc2c3c(nn2C)CCC3)cc1
InChIInChI=1S/C16H20N4O/c1-19(2)12-9-7-11(8-10-12)16(21)17-15-13-5-4-6-14(13)18-20(15)3/h7-10H,4-6H2,1-3H3,(H,17,21)
InChIKeyLLPYVSCDEOPSDN-UHFFFAOYSA-N
XLogP2.23
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(dimethylamino)-N-(2-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)benzamide?
The IUPAC name of 4-(dimethylamino)-N-(2-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)benzamide (CID 30859118) is 4-(dimethylamino)-N-(2-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)benzamide.
What is the SMILES notation for 4-(dimethylamino)-N-(2-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)benzamide?
The canonical SMILES for 4-(dimethylamino)-N-(2-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)benzamide is CN(C)c1ccc(C(=O)Nc2c3c(nn2C)CCC3)cc1.
What is the InChIKey of 4-(dimethylamino)-N-(2-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)benzamide?
The InChIKey is LLPYVSCDEOPSDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O/c1-19(2)12-9-7-11(8-10-12)16(21)17-15-13-5-4-6-14(13)18-20(15)3/h7-10H,4-6H2,1-3H3,(H,17,21).
What are the key properties of 4-(dimethylamino)-N-(2-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)benzamide?
4-(dimethylamino)-N-(2-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)benzamide has a molecular weight of 284.36 g/mol, XLogP of 2.23, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dimethylamino)-N-(2-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)benzamide is sourced from PubChem (CID 30859118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).