5-ethyl-N-[[1-(pyrazol-1-ylmethyl)cyclopropyl]methyl]-1H-pyrrole-2-carboxamide

C15H20N4O — CID 122563230

IUPAC5-ethyl-N-[[1-(pyrazol-1-ylmethyl)cyclopropyl]methyl]-1H-pyrrole-2-carboxamide
SMILESCCc1ccc(C(=O)NCC2(Cn3cccn3)CC2)[nH]1
InChIInChI=1S/C15H20N4O/c1-2-12-4-5-13(18-12)14(20)16-10-15(6-7-15)11-19-9-3-8-17-19/h3-5,8-9,18H,2,6-7,10-11H2,1H3,(H,16,20)
InChIKeyNRCIUINTGMTNGS-UHFFFAOYSA-N
MW272.35 g/mol
LogP1.98
Rot. Bonds6

About 5-ethyl-N-[[1-(pyrazol-1-ylmethyl)cyclopropyl]methyl]-1H-pyrrole-2-carboxamide

5-ethyl-N-[[1-(pyrazol-1-ylmethyl)cyclopropyl]methyl]-1H-pyrrole-2-carboxamide (PubChem CID 122563230) has the molecular formula C15H20N4O and a molecular weight of 272.35 g/mol. Its IUPAC name is 5-ethyl-N-[[1-(pyrazol-1-ylmethyl)cyclopropyl]methyl]-1H-pyrrole-2-carboxamide.

Molecular Properties

Compound Name5-ethyl-N-[[1-(pyrazol-1-ylmethyl)cyclopropyl]methyl]-1H-pyrrole-2-carboxamide
PubChem CID122563230
Molecular FormulaC15H20N4O
Molecular Weight272.35 g/mol
Exact Mass272.16
IUPAC Name5-ethyl-N-[[1-(pyrazol-1-ylmethyl)cyclopropyl]methyl]-1H-pyrrole-2-carboxamide
SMILESCCc1ccc(C(=O)NCC2(Cn3cccn3)CC2)[nH]1
InChIInChI=1S/C15H20N4O/c1-2-12-4-5-13(18-12)14(20)16-10-15(6-7-15)11-19-9-3-8-17-19/h3-5,8-9,18H,2,6-7,10-11H2,1H3,(H,16,20)
InChIKeyNRCIUINTGMTNGS-UHFFFAOYSA-N
XLogP1.98
TPSA62.71 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 51.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-methoxy-N-[[1-(pyrazol-1-ylmethyl)cyclopropyl]methyl]pyridine-4-carboxamide
CID 122568384
3-methyl-N-[[1-(pyrazol-1-ylmethyl)cyclopropyl]methyl]imidazole-4-carboxamide
CID 122559752
6-amino-N-[[1-(pyrazol-1-ylmethyl)cyclopropyl]methyl]pyridine-3-carboxamide
CID 91762623
2-(4-phenylphenyl)-N-[[1-(pyrazol-1-ylmethyl)cyclopropyl]methyl]acetamide
CID 91779095
5-propan-2-yl-N-[[1-(pyrazol-1-ylmethyl)cyclopropyl]methyl]-1,3-oxazole-4-carboxamide
CID 122563952
2-amino-6-methyl-N-[[1-(pyrazol-1-ylmethyl)cyclopropyl]methyl]pyrimidine-4-carboxamide
CID 56702160
3,6,7-trimethyl-N-[[1-(pyrazol-1-ylmethyl)cyclopropyl]methyl]-1-benzofuran-2-carboxamide
CID 70754476
1-[5-(4-methylphenyl)-1H-imidazol-2-yl]-3-[[1-(pyrazol-1-ylmethyl)cyclopropyl]methyl]urea
CID 29184093
N-[[1-(pyrazol-1-ylmethyl)cyclopropyl]methyl]-2-pyridin-4-ylsulfanylacetamide
CID 91783003
(2R)-2-phenyl-N-[[1-(pyrazol-1-ylmethyl)cyclopropyl]methyl]spiro[2.4]heptane-2-carboxamide
CID 126433749
N-[[1-(pyrazol-1-ylmethyl)cyclopropyl]methyl]-1,3-benzothiazole-5-carboxamide
CID 56743555
2-(furan-2-yl)-2-oxo-N-[[1-(pyrazol-1-ylmethyl)cyclopropyl]methyl]acetamide
CID 91774286

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-N-[[1-(pyrazol-1-ylmethyl)cyclopropyl]methyl]-1H-pyrrole-2-carboxamide?
The IUPAC name of 5-ethyl-N-[[1-(pyrazol-1-ylmethyl)cyclopropyl]methyl]-1H-pyrrole-2-carboxamide (CID 122563230) is 5-ethyl-N-[[1-(pyrazol-1-ylmethyl)cyclopropyl]methyl]-1H-pyrrole-2-carboxamide.
What is the SMILES notation for 5-ethyl-N-[[1-(pyrazol-1-ylmethyl)cyclopropyl]methyl]-1H-pyrrole-2-carboxamide?
The canonical SMILES for 5-ethyl-N-[[1-(pyrazol-1-ylmethyl)cyclopropyl]methyl]-1H-pyrrole-2-carboxamide is CCc1ccc(C(=O)NCC2(Cn3cccn3)CC2)[nH]1.
What is the InChIKey of 5-ethyl-N-[[1-(pyrazol-1-ylmethyl)cyclopropyl]methyl]-1H-pyrrole-2-carboxamide?
The InChIKey is NRCIUINTGMTNGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O/c1-2-12-4-5-13(18-12)14(20)16-10-15(6-7-15)11-19-9-3-8-17-19/h3-5,8-9,18H,2,6-7,10-11H2,1H3,(H,16,20).
What are the key properties of 5-ethyl-N-[[1-(pyrazol-1-ylmethyl)cyclopropyl]methyl]-1H-pyrrole-2-carboxamide?
5-ethyl-N-[[1-(pyrazol-1-ylmethyl)cyclopropyl]methyl]-1H-pyrrole-2-carboxamide has a molecular weight of 272.35 g/mol, XLogP of 1.98, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-N-[[1-(pyrazol-1-ylmethyl)cyclopropyl]methyl]-1H-pyrrole-2-carboxamide is sourced from PubChem (CID 122563230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).