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

C11H21N5O — CID 66017701

IUPAC2-[(4-amino-1-methyl-3-propylpyrazol-5-yl)amino]-N-methylpropanamide
SMILESCCCc1nn(C)c(NC(C)C(=O)NC)c1N
InChIInChI=1S/C11H21N5O/c1-5-6-8-9(12)10(16(4)15-8)14-7(2)11(17)13-3/h7,14H,5-6,12H2,1-4H3,(H,13,17)
InChIKeyFSRMCACWGPNXEF-UHFFFAOYSA-N
MW239.32 g/mol
LogP0.50
Rot. Bonds5

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

2-[(4-amino-1-methyl-3-propylpyrazol-5-yl)amino]-N-methylpropanamide (PubChem CID 66017701) has the molecular formula C11H21N5O and a molecular weight of 239.32 g/mol. Its IUPAC name is 2-[(4-amino-1-methyl-3-propylpyrazol-5-yl)amino]-N-methylpropanamide.

Molecular Properties

Compound Name2-[(4-amino-1-methyl-3-propylpyrazol-5-yl)amino]-N-methylpropanamide
PubChem CID66017701
Molecular FormulaC11H21N5O
Molecular Weight239.32 g/mol
Exact Mass239.17
IUPAC Name2-[(4-amino-1-methyl-3-propylpyrazol-5-yl)amino]-N-methylpropanamide
SMILESCCCc1nn(C)c(NC(C)C(=O)NC)c1N
InChIInChI=1S/C11H21N5O/c1-5-6-8-9(12)10(16(4)15-8)14-7(2)11(17)13-3/h7,14H,5-6,12H2,1-4H3,(H,13,17)
InChIKeyFSRMCACWGPNXEF-UHFFFAOYSA-N
XLogP0.50
TPSA84.97 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 50.50
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-methyl-2-[(1-methyl-4-nitro-3-propylpyrazol-5-yl)amino]propanamide
CID 66018839
1-methyl-5-N-(5-methylhexan-2-yl)-3-propylpyrazole-4,5-diamine
CID 66018319
5-N-[1-(diethylamino)propan-2-yl]-1-methyl-3-propylpyrazole-4,5-diamine
CID 66017334
3-[(4-amino-1-methyl-3-propylpyrazol-5-yl)amino]-N,2,2-trimethylpropanamide
CID 106275315
1-methyl-5-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-3-propylpyrazole-4,5-diamine
CID 106387614
2-[(4-amino-3-ethyl-1-methylpyrazol-5-yl)amino]-N-ethyl-N-methylpropanamide
CID 103106733
1-methyl-5-N-(1-phenylethyl)-3-propylpyrazole-4,5-diamine
CID 66018634
5-N-(1-methoxy-3-methylbutan-2-yl)-1-methyl-3-propylpyrazole-4,5-diamine
CID 66017741
2-[(4-amino-1-methyl-3-propylpyrazol-5-yl)amino]-2-methylpropanamide
CID 66019658
1-methyl-5-N-(4-methylpentyl)-3-propylpyrazole-4,5-diamine
CID 66019860
2-[(1-methyl-4-nitro-3-propylpyrazol-5-yl)amino]-N-propylpropanamide
CID 66019999
N-(4-amino-1-methyl-3-propylpyrazol-5-yl)formamide;hydrochloride
CID 174670115

Frequently Asked Questions

What is the IUPAC name of 2-[(4-amino-1-methyl-3-propylpyrazol-5-yl)amino]-N-methylpropanamide?
The IUPAC name of 2-[(4-amino-1-methyl-3-propylpyrazol-5-yl)amino]-N-methylpropanamide (CID 66017701) is 2-[(4-amino-1-methyl-3-propylpyrazol-5-yl)amino]-N-methylpropanamide.
What is the SMILES notation for 2-[(4-amino-1-methyl-3-propylpyrazol-5-yl)amino]-N-methylpropanamide?
The canonical SMILES for 2-[(4-amino-1-methyl-3-propylpyrazol-5-yl)amino]-N-methylpropanamide is CCCc1nn(C)c(NC(C)C(=O)NC)c1N.
What is the InChIKey of 2-[(4-amino-1-methyl-3-propylpyrazol-5-yl)amino]-N-methylpropanamide?
The InChIKey is FSRMCACWGPNXEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N5O/c1-5-6-8-9(12)10(16(4)15-8)14-7(2)11(17)13-3/h7,14H,5-6,12H2,1-4H3,(H,13,17).
What are the key properties of 2-[(4-amino-1-methyl-3-propylpyrazol-5-yl)amino]-N-methylpropanamide?
2-[(4-amino-1-methyl-3-propylpyrazol-5-yl)amino]-N-methylpropanamide has a molecular weight of 239.32 g/mol, XLogP of 0.50, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-amino-1-methyl-3-propylpyrazol-5-yl)amino]-N-methylpropanamide is sourced from PubChem (CID 66017701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).