N-cyclopropyl-2-phenyl-2,3-dihydro-1H-imidazo[2,1-e]pyrazole-7-carboxamide

C15H16N4O — CID 135796853

IUPACN-cyclopropyl-2-phenyl-2,3-dihydro-1H-imidazo[2,1-e]pyrazole-7-carboxamide
SMILESO=C(NC1CC1)c1cnn2c1NC(c1ccccc1)C2
InChIInChI=1S/C15H16N4O/c20-15(17-11-6-7-11)12-8-16-19-9-13(18-14(12)19)10-4-2-1-3-5-10/h1-5,8,11,13,18H,6-7,9H2,(H,17,20)
InChIKeyKTVSDQCADVEAQG-UHFFFAOYSA-N
MW268.32 g/mol
LogP1.94
Rot. Bonds3

About N-cyclopropyl-2-phenyl-2,3-dihydro-1H-imidazo[2,1-e]pyrazole-7-carboxamide

N-cyclopropyl-2-phenyl-2,3-dihydro-1H-imidazo[2,1-e]pyrazole-7-carboxamide (PubChem CID 135796853) has the molecular formula C15H16N4O and a molecular weight of 268.32 g/mol. Its IUPAC name is N-cyclopropyl-2-phenyl-2,3-dihydro-1H-imidazo[2,1-e]pyrazole-7-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-2-phenyl-2,3-dihydro-1H-imidazo[2,1-e]pyrazole-7-carboxamide
PubChem CID135796853
Molecular FormulaC15H16N4O
Molecular Weight268.32 g/mol
Exact Mass268.13
IUPAC NameN-cyclopropyl-2-phenyl-2,3-dihydro-1H-imidazo[2,1-e]pyrazole-7-carboxamide
SMILESO=C(NC1CC1)c1cnn2c1NC(c1ccccc1)C2
InChIInChI=1S/C15H16N4O/c20-15(17-11-6-7-11)12-8-16-19-9-13(18-14(12)19)10-4-2-1-3-5-10/h1-5,8,11,13,18H,6-7,9H2,(H,17,20)
InChIKeyKTVSDQCADVEAQG-UHFFFAOYSA-N
XLogP1.94
TPSA58.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 51.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-Benzyl-1-cyclopentyl-1,5-dihydro-4h-pyrazolo[3,4-d]pyrimidin-4-one
CID 135566500
6-[(3s,4s)-1-Benzyl-4-Methylpyrrolidin-3-Yl]-1-(1-Methylethyl)-1,5-Dihydro-4h-Pyrazolo[3,4-D]pyrimidin-4-One
CID 135566501
trans-1-cyclopentyl-6-(4-methyl-1-(3-methylbenzyl)pyrrolidin-3-yl)-1H-pyrazolo[3,4-d]pyrimidin-4(5H)-one
CID 135860086
1-cyclopentyl-6-[(1R)-1-(3-phenylpyrrolidin-1-yl)ethyl]-5H-pyrazolo[5,4-d]pyrimidin-4-one
CID 135873914
trans-6-(1-benzyl-4-methylpyrrolidin-3-yl)-1-cyclopentyl-1H-pyrazolo[3,4-d]pyrimidin-4(5H)-one
CID 135875901
1-Benzyl-1H-pyrazolo[3,4-d]pyrimidin-4-ol
CID 135431262
DPP-4 ligand 16
CID 23647144
2-(1-tert-butyl-4-oxopyrazolo[3,4-d]pyrimidin-5-yl)-N-[(4-fluorophenyl)methyl]acetamide
CID 3241861
N-benzyl-2-(1-(tert-butyl)-4-oxo-1H-pyrazolo[3,4-d]pyrimidin-5(4H)-yl)acetamide
CID 3244301
1-N-(2-fluorophenyl)-2-phenyl-2,3-dihydroimidazo[2,1-e]pyrazole-1,7-dicarboxamide
CID 56971035
1-N-(3-fluorophenyl)-2-phenyl-2,3-dihydroimidazo[2,1-e]pyrazole-1,7-dicarboxamide
CID 56971036
1-N-(4-fluorophenyl)-2-phenyl-2,3-dihydroimidazo[2,1-e]pyrazole-1,7-dicarboxamide
CID 56971037

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-phenyl-2,3-dihydro-1H-imidazo[2,1-e]pyrazole-7-carboxamide?
The IUPAC name of N-cyclopropyl-2-phenyl-2,3-dihydro-1H-imidazo[2,1-e]pyrazole-7-carboxamide (CID 135796853) is N-cyclopropyl-2-phenyl-2,3-dihydro-1H-imidazo[2,1-e]pyrazole-7-carboxamide.
What is the SMILES notation for N-cyclopropyl-2-phenyl-2,3-dihydro-1H-imidazo[2,1-e]pyrazole-7-carboxamide?
The canonical SMILES for N-cyclopropyl-2-phenyl-2,3-dihydro-1H-imidazo[2,1-e]pyrazole-7-carboxamide is O=C(NC1CC1)c1cnn2c1NC(c1ccccc1)C2.
What is the InChIKey of N-cyclopropyl-2-phenyl-2,3-dihydro-1H-imidazo[2,1-e]pyrazole-7-carboxamide?
The InChIKey is KTVSDQCADVEAQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4O/c20-15(17-11-6-7-11)12-8-16-19-9-13(18-14(12)19)10-4-2-1-3-5-10/h1-5,8,11,13,18H,6-7,9H2,(H,17,20).
What are the key properties of N-cyclopropyl-2-phenyl-2,3-dihydro-1H-imidazo[2,1-e]pyrazole-7-carboxamide?
N-cyclopropyl-2-phenyl-2,3-dihydro-1H-imidazo[2,1-e]pyrazole-7-carboxamide has a molecular weight of 268.32 g/mol, XLogP of 1.94, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-phenyl-2,3-dihydro-1H-imidazo[2,1-e]pyrazole-7-carboxamide is sourced from PubChem (CID 135796853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).