2-[(4-amino-3-methyl-1-propylpyrazol-5-yl)amino]-N-cyclopropylacetamide

C12H21N5O — CID 66029167

IUPAC2-[(4-amino-3-methyl-1-propylpyrazol-5-yl)amino]-N-cyclopropylacetamide
SMILESCCCn1nc(C)c(N)c1NCC(=O)NC1CC1
InChIInChI=1S/C12H21N5O/c1-3-6-17-12(11(13)8(2)16-17)14-7-10(18)15-9-4-5-9/h9,14H,3-7,13H2,1-2H3,(H,15,18)
InChIKeyLOKOCNUDSZAJGI-UHFFFAOYSA-N
MW251.33 g/mol
LogP0.87
Rot. Bonds6

About 2-[(4-amino-3-methyl-1-propylpyrazol-5-yl)amino]-N-cyclopropylacetamide

2-[(4-amino-3-methyl-1-propylpyrazol-5-yl)amino]-N-cyclopropylacetamide (PubChem CID 66029167) has the molecular formula C12H21N5O and a molecular weight of 251.33 g/mol. Its IUPAC name is 2-[(4-amino-3-methyl-1-propylpyrazol-5-yl)amino]-N-cyclopropylacetamide.

Molecular Properties

Compound Name2-[(4-amino-3-methyl-1-propylpyrazol-5-yl)amino]-N-cyclopropylacetamide
PubChem CID66029167
Molecular FormulaC12H21N5O
Molecular Weight251.33 g/mol
Exact Mass251.17
IUPAC Name2-[(4-amino-3-methyl-1-propylpyrazol-5-yl)amino]-N-cyclopropylacetamide
SMILESCCCn1nc(C)c(N)c1NCC(=O)NC1CC1
InChIInChI=1S/C12H21N5O/c1-3-6-17-12(11(13)8(2)16-17)14-7-10(18)15-9-4-5-9/h9,14H,3-7,13H2,1-2H3,(H,15,18)
InChIKeyLOKOCNUDSZAJGI-UHFFFAOYSA-N
XLogP0.87
TPSA84.97 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.33
LogP ≤ 50.87
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

3-methyl-5-N-(4-methylcyclohexyl)-1-propylpyrazole-4,5-diamine
CID 66027024
5-[[(4-amino-3-methyl-1-propylpyrazol-5-yl)amino]methyl]pyrrolidin-2-one
CID 66027289
3-[(4-amino-3-methyl-1-propylpyrazol-5-yl)amino]cyclobutan-1-ol
CID 66029998
2-[(4-amino-3-methyl-1-propylpyrazol-5-yl)amino]ethanesulfonamide
CID 66028394
2-[(4-amino-3-methyl-1-propylpyrazol-5-yl)amino]-2-methylpropan-1-ol
CID 66029551
2-(4-amino-3,5-dimethylpyrazol-1-yl)-N-(4-ethylcyclohexyl)acetamide
CID 61466568
5-N-(3-cyclopentylpropyl)-3-methyl-1-propylpyrazole-4,5-diamine
CID 106007196
3-methyl-5-N-(2-methylbutan-2-yl)-1-propylpyrazole-4,5-diamine
CID 66027987
2-(4-amino-3,5-dimethylpyrazol-1-yl)-N-(4-hydroxycyclohexyl)acetamide
CID 43445175
4-amino-1-ethyl-3-methyl-N-(4-methylcyclohexyl)pyrazole-5-carboxamide
CID 66124433
[2-(cyclopropylamino)-2-oxoethyl] 2-(4-amino-3,5-dimethylpyrazol-1-yl)acetate
CID 61321043
4-[(4-amino-3-methyl-1-propan-2-ylpyrazol-5-yl)amino]-N-cyclopropylbutanamide
CID 79394730

Frequently Asked Questions

What is the IUPAC name of 2-[(4-amino-3-methyl-1-propylpyrazol-5-yl)amino]-N-cyclopropylacetamide?
The IUPAC name of 2-[(4-amino-3-methyl-1-propylpyrazol-5-yl)amino]-N-cyclopropylacetamide (CID 66029167) is 2-[(4-amino-3-methyl-1-propylpyrazol-5-yl)amino]-N-cyclopropylacetamide.
What is the SMILES notation for 2-[(4-amino-3-methyl-1-propylpyrazol-5-yl)amino]-N-cyclopropylacetamide?
The canonical SMILES for 2-[(4-amino-3-methyl-1-propylpyrazol-5-yl)amino]-N-cyclopropylacetamide is CCCn1nc(C)c(N)c1NCC(=O)NC1CC1.
What is the InChIKey of 2-[(4-amino-3-methyl-1-propylpyrazol-5-yl)amino]-N-cyclopropylacetamide?
The InChIKey is LOKOCNUDSZAJGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N5O/c1-3-6-17-12(11(13)8(2)16-17)14-7-10(18)15-9-4-5-9/h9,14H,3-7,13H2,1-2H3,(H,15,18).
What are the key properties of 2-[(4-amino-3-methyl-1-propylpyrazol-5-yl)amino]-N-cyclopropylacetamide?
2-[(4-amino-3-methyl-1-propylpyrazol-5-yl)amino]-N-cyclopropylacetamide has a molecular weight of 251.33 g/mol, XLogP of 0.87, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-amino-3-methyl-1-propylpyrazol-5-yl)amino]-N-cyclopropylacetamide is sourced from PubChem (CID 66029167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).