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

C13H25N5O — CID 103106758

IUPAC2-[(4-amino-3-methyl-1-propylpyrazol-5-yl)amino]-N-ethyl-N-methylpropanamide
SMILESCCCn1nc(C)c(N)c1NC(C)C(=O)N(C)CC
InChIInChI=1S/C13H25N5O/c1-6-8-18-12(11(14)9(3)16-18)15-10(4)13(19)17(5)7-2/h10,15H,6-8,14H2,1-5H3
InChIKeyOHVQWUWXHXQQPF-UHFFFAOYSA-N
MW267.38 g/mol
LogP1.46
Rot. Bonds6

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

2-[(4-amino-3-methyl-1-propylpyrazol-5-yl)amino]-N-ethyl-N-methylpropanamide (PubChem CID 103106758) has the molecular formula C13H25N5O and a molecular weight of 267.38 g/mol. Its IUPAC name is 2-[(4-amino-3-methyl-1-propylpyrazol-5-yl)amino]-N-ethyl-N-methylpropanamide.

Molecular Properties

Compound Name2-[(4-amino-3-methyl-1-propylpyrazol-5-yl)amino]-N-ethyl-N-methylpropanamide
PubChem CID103106758
Molecular FormulaC13H25N5O
Molecular Weight267.38 g/mol
Exact Mass267.21
IUPAC Name2-[(4-amino-3-methyl-1-propylpyrazol-5-yl)amino]-N-ethyl-N-methylpropanamide
SMILESCCCn1nc(C)c(N)c1NC(C)C(=O)N(C)CC
InChIInChI=1S/C13H25N5O/c1-6-8-18-12(11(14)9(3)16-18)15-10(4)13(19)17(5)7-2/h10,15H,6-8,14H2,1-5H3
InChIKeyOHVQWUWXHXQQPF-UHFFFAOYSA-N
XLogP1.46
TPSA76.18 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.38
LogP ≤ 51.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[(4-amino-3-ethyl-1-methylpyrazol-5-yl)amino]-N-ethyl-N-methylpropanamide
CID 103106733
3-methyl-5-N-octan-4-yl-1-propylpyrazole-4,5-diamine
CID 106022611
3-methyl-1-propyl-5-N-[1-(2H-tetrazol-5-yl)ethyl]pyrazole-4,5-diamine
CID 66028999
2-[(4-amino-1,3-dimethylpyrazol-5-yl)amino]propanamide
CID 43554343
2-[(4-amino-1,3-benzothiazol-5-yl)amino]-N-ethyl-N-methylpropanamide
CID 103106749
2-[(4-amino-3-methyl-1-propylpyrazol-5-yl)amino]-2-methylpropan-1-ol
CID 66029551
2-[(3-amino-4-methyl-1,2-thiazol-5-yl)amino]-N-ethyl-N-methylpropanamide
CID 103365951
3-methyl-5-N-(2-methylbutan-2-yl)-1-propylpyrazole-4,5-diamine
CID 66027987
2-[(4-amino-3-methyl-1-propylpyrazol-5-yl)amino]-N-cyclopropylacetamide
CID 66029167
5-amino-6-[[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]amino]pyridine-3-carboxylic acid
CID 103113348
N-ethyl-2-[1-(1-ethyl-3,5-dimethylpyrazol-4-yl)ethylamino]-N-methylpropanamide
CID 103107285
2-[(3-amino-1,2-thiazol-5-yl)amino]-N-ethyl-N-methylpropanamide
CID 103365954

Frequently Asked Questions

What is the IUPAC name of 2-[(4-amino-3-methyl-1-propylpyrazol-5-yl)amino]-N-ethyl-N-methylpropanamide?
The IUPAC name of 2-[(4-amino-3-methyl-1-propylpyrazol-5-yl)amino]-N-ethyl-N-methylpropanamide (CID 103106758) is 2-[(4-amino-3-methyl-1-propylpyrazol-5-yl)amino]-N-ethyl-N-methylpropanamide.
What is the SMILES notation for 2-[(4-amino-3-methyl-1-propylpyrazol-5-yl)amino]-N-ethyl-N-methylpropanamide?
The canonical SMILES for 2-[(4-amino-3-methyl-1-propylpyrazol-5-yl)amino]-N-ethyl-N-methylpropanamide is CCCn1nc(C)c(N)c1NC(C)C(=O)N(C)CC.
What is the InChIKey of 2-[(4-amino-3-methyl-1-propylpyrazol-5-yl)amino]-N-ethyl-N-methylpropanamide?
The InChIKey is OHVQWUWXHXQQPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N5O/c1-6-8-18-12(11(14)9(3)16-18)15-10(4)13(19)17(5)7-2/h10,15H,6-8,14H2,1-5H3.
What are the key properties of 2-[(4-amino-3-methyl-1-propylpyrazol-5-yl)amino]-N-ethyl-N-methylpropanamide?
2-[(4-amino-3-methyl-1-propylpyrazol-5-yl)amino]-N-ethyl-N-methylpropanamide has a molecular weight of 267.38 g/mol, XLogP of 1.46, 6 rotatable bonds, 2 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-ethyl-N-methylpropanamide is sourced from PubChem (CID 103106758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).