4-amino-N-(2-amino-2-oxoethyl)-N-cyclopentyl-5-ethyl-1H-pyrazole-3-carboxamide

C13H21N5O2 — CID 62082354

IUPAC4-amino-N-(2-amino-2-oxoethyl)-N-cyclopentyl-5-ethyl-1H-pyrazole-3-carboxamide
SMILESCCc1[nH]nc(C(=O)N(CC(N)=O)C2CCCC2)c1N
InChIInChI=1S/C13H21N5O2/c1-2-9-11(15)12(17-16-9)13(20)18(7-10(14)19)8-5-3-4-6-8/h8H,2-7,15H2,1H3,(H2,14,19)(H,16,17)
InChIKeySHCMQNKXOIODTI-UHFFFAOYSA-N
MW279.34 g/mol
LogP0.42
Rot. Bonds5

About 4-amino-N-(2-amino-2-oxoethyl)-N-cyclopentyl-5-ethyl-1H-pyrazole-3-carboxamide

4-amino-N-(2-amino-2-oxoethyl)-N-cyclopentyl-5-ethyl-1H-pyrazole-3-carboxamide (PubChem CID 62082354) has the molecular formula C13H21N5O2 and a molecular weight of 279.34 g/mol. Its IUPAC name is 4-amino-N-(2-amino-2-oxoethyl)-N-cyclopentyl-5-ethyl-1H-pyrazole-3-carboxamide.

Molecular Properties

Compound Name4-amino-N-(2-amino-2-oxoethyl)-N-cyclopentyl-5-ethyl-1H-pyrazole-3-carboxamide
PubChem CID62082354
Molecular FormulaC13H21N5O2
Molecular Weight279.34 g/mol
Exact Mass279.17
IUPAC Name4-amino-N-(2-amino-2-oxoethyl)-N-cyclopentyl-5-ethyl-1H-pyrazole-3-carboxamide
SMILESCCc1[nH]nc(C(=O)N(CC(N)=O)C2CCCC2)c1N
InChIInChI=1S/C13H21N5O2/c1-2-9-11(15)12(17-16-9)13(20)18(7-10(14)19)8-5-3-4-6-8/h8H,2-7,15H2,1H3,(H2,14,19)(H,16,17)
InChIKeySHCMQNKXOIODTI-UHFFFAOYSA-N
XLogP0.42
TPSA118.10 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.34
LogP ≤ 50.42
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

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4-amino-N-benzyl-N-cyclopropyl-5-ethyl-1H-pyrazole-3-carboxamide
CID 62081458
4-amino-N-cyclobutyl-N-(3-hydroxypropyl)-5-propyl-1H-pyrazole-3-carboxamide
CID 102858736
4-amino-N-cyclopropyl-5-ethyl-N-[(1-methylimidazol-2-yl)methyl]-1H-pyrazole-3-carboxamide
CID 62082526
methyl 2-[(4-amino-5-ethyl-1H-pyrazole-3-carbonyl)-ethylamino]acetate
CID 62080806
2,3,3a,4,5,6,7,7a-octahydroindol-1-yl-(4-amino-5-ethyl-1H-pyrazol-3-yl)methanone
CID 82746456
4-amino-5-ethyl-N-(2-methylcyclohexyl)-1H-pyrazole-3-carboxamide
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4-amino-N-(2-amino-2-oxoethyl)-N-cyclopentyl-1-methylpyrazole-3-carboxamide
CID 65354599
4-amino-5-ethyl-N-methyl-N-[(1-methylpiperidin-4-yl)methyl]-1H-pyrazole-3-carboxamide
CID 63233091
4-amino-N,N-dibutyl-5-ethyl-1H-pyrazole-3-carboxamide
CID 62080934
4-amino-N-[2-(dimethylamino)ethyl]-5-ethyl-N-methyl-1H-pyrazole-3-carboxamide
CID 63694755

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(2-amino-2-oxoethyl)-N-cyclopentyl-5-ethyl-1H-pyrazole-3-carboxamide?
The IUPAC name of 4-amino-N-(2-amino-2-oxoethyl)-N-cyclopentyl-5-ethyl-1H-pyrazole-3-carboxamide (CID 62082354) is 4-amino-N-(2-amino-2-oxoethyl)-N-cyclopentyl-5-ethyl-1H-pyrazole-3-carboxamide.
What is the SMILES notation for 4-amino-N-(2-amino-2-oxoethyl)-N-cyclopentyl-5-ethyl-1H-pyrazole-3-carboxamide?
The canonical SMILES for 4-amino-N-(2-amino-2-oxoethyl)-N-cyclopentyl-5-ethyl-1H-pyrazole-3-carboxamide is CCc1[nH]nc(C(=O)N(CC(N)=O)C2CCCC2)c1N.
What is the InChIKey of 4-amino-N-(2-amino-2-oxoethyl)-N-cyclopentyl-5-ethyl-1H-pyrazole-3-carboxamide?
The InChIKey is SHCMQNKXOIODTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N5O2/c1-2-9-11(15)12(17-16-9)13(20)18(7-10(14)19)8-5-3-4-6-8/h8H,2-7,15H2,1H3,(H2,14,19)(H,16,17).
What are the key properties of 4-amino-N-(2-amino-2-oxoethyl)-N-cyclopentyl-5-ethyl-1H-pyrazole-3-carboxamide?
4-amino-N-(2-amino-2-oxoethyl)-N-cyclopentyl-5-ethyl-1H-pyrazole-3-carboxamide has a molecular weight of 279.34 g/mol, XLogP of 0.42, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(2-amino-2-oxoethyl)-N-cyclopentyl-5-ethyl-1H-pyrazole-3-carboxamide is sourced from PubChem (CID 62082354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).