4-amino-N-(2-amino-2-oxoethyl)-N-cyclopentyl-1-methylpyrazole-3-carboxamide

C12H19N5O2 — CID 65354599

IUPAC4-amino-N-(2-amino-2-oxoethyl)-N-cyclopentyl-1-methylpyrazole-3-carboxamide
SMILESCn1cc(N)c(C(=O)N(CC(N)=O)C2CCCC2)n1
InChIInChI=1S/C12H19N5O2/c1-16-6-9(13)11(15-16)12(19)17(7-10(14)18)8-4-2-3-5-8/h6,8H,2-5,7,13H2,1H3,(H2,14,18)
InChIKeyLQJQZYAGKIQICJ-UHFFFAOYSA-N
MW265.32 g/mol
LogP-0.13
Rot. Bonds4

About 4-amino-N-(2-amino-2-oxoethyl)-N-cyclopentyl-1-methylpyrazole-3-carboxamide

4-amino-N-(2-amino-2-oxoethyl)-N-cyclopentyl-1-methylpyrazole-3-carboxamide (PubChem CID 65354599) has the molecular formula C12H19N5O2 and a molecular weight of 265.32 g/mol. Its IUPAC name is 4-amino-N-(2-amino-2-oxoethyl)-N-cyclopentyl-1-methylpyrazole-3-carboxamide.

Molecular Properties

Compound Name4-amino-N-(2-amino-2-oxoethyl)-N-cyclopentyl-1-methylpyrazole-3-carboxamide
PubChem CID65354599
Molecular FormulaC12H19N5O2
Molecular Weight265.32 g/mol
Exact Mass265.15
IUPAC Name4-amino-N-(2-amino-2-oxoethyl)-N-cyclopentyl-1-methylpyrazole-3-carboxamide
SMILESCn1cc(N)c(C(=O)N(CC(N)=O)C2CCCC2)n1
InChIInChI=1S/C12H19N5O2/c1-16-6-9(13)11(15-16)12(19)17(7-10(14)18)8-4-2-3-5-8/h6,8H,2-5,7,13H2,1H3,(H2,14,18)
InChIKeyLQJQZYAGKIQICJ-UHFFFAOYSA-N
XLogP-0.13
TPSA107.24 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.32
LogP ≤ 5-0.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-amino-N-cyclopentyl-N-[2-(dimethylamino)ethyl]-1-methylpyrazole-3-carboxamide
CID 65353932
4-amino-N-cyclopentyl-N-[2-(dimethylamino)ethyl]-1-ethylpyrazole-3-carboxamide
CID 65358199
4-amino-N,N-diethyl-1-methylpyrazole-3-carboxamide
CID 65355148
4-amino-N-(2-amino-2-oxoethyl)-N-cyclopentyl-5-ethyl-1H-pyrazole-3-carboxamide
CID 62082354
2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl-(4-amino-1-methylpyrazol-3-yl)methanone
CID 65355991
(4-amino-1-methylpyrazol-3-yl)-[4-(diethylamino)piperidin-1-yl]methanone
CID 65354317
4-amino-N-cyclohexyl-N-methyl-1-propylpyrazole-3-carboxamide
CID 132586474
N-(2-amino-2-oxoethyl)-N-cyclopentyl-3,5-dimethylbenzamide
CID 47212500
N-(2-amino-2-oxoethyl)-1-methyl-N-piperidin-3-ylpyrazole-4-carboxamide
CID 60800702
N-(2-amino-2-hydroxyiminoethyl)-N-cyclopentyl-1-methylimidazole-4-carboxamide
CID 107974303
N-(2-amino-2-oxoethyl)-2-(4-aminopyrazol-1-yl)-N-cyclopentylacetamide
CID 61110215
4-amino-1-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]pyrazole-3-carboxamide
CID 106021956

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(2-amino-2-oxoethyl)-N-cyclopentyl-1-methylpyrazole-3-carboxamide?
The IUPAC name of 4-amino-N-(2-amino-2-oxoethyl)-N-cyclopentyl-1-methylpyrazole-3-carboxamide (CID 65354599) is 4-amino-N-(2-amino-2-oxoethyl)-N-cyclopentyl-1-methylpyrazole-3-carboxamide.
What is the SMILES notation for 4-amino-N-(2-amino-2-oxoethyl)-N-cyclopentyl-1-methylpyrazole-3-carboxamide?
The canonical SMILES for 4-amino-N-(2-amino-2-oxoethyl)-N-cyclopentyl-1-methylpyrazole-3-carboxamide is Cn1cc(N)c(C(=O)N(CC(N)=O)C2CCCC2)n1.
What is the InChIKey of 4-amino-N-(2-amino-2-oxoethyl)-N-cyclopentyl-1-methylpyrazole-3-carboxamide?
The InChIKey is LQJQZYAGKIQICJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N5O2/c1-16-6-9(13)11(15-16)12(19)17(7-10(14)18)8-4-2-3-5-8/h6,8H,2-5,7,13H2,1H3,(H2,14,18).
What are the key properties of 4-amino-N-(2-amino-2-oxoethyl)-N-cyclopentyl-1-methylpyrazole-3-carboxamide?
4-amino-N-(2-amino-2-oxoethyl)-N-cyclopentyl-1-methylpyrazole-3-carboxamide has a molecular weight of 265.32 g/mol, XLogP of -0.13, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(2-amino-2-oxoethyl)-N-cyclopentyl-1-methylpyrazole-3-carboxamide is sourced from PubChem (CID 65354599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).