5-N-(2-methoxycyclopentyl)-3-methyl-1-propylpyrazole-4,5-diamine

C13H24N4O — CID 66029779

IUPAC5-N-(2-methoxycyclopentyl)-3-methyl-1-propylpyrazole-4,5-diamine
SMILESCCCn1nc(C)c(N)c1NC1CCCC1OC
InChIInChI=1S/C13H24N4O/c1-4-8-17-13(12(14)9(2)16-17)15-10-6-5-7-11(10)18-3/h10-11,15H,4-8,14H2,1-3H3
InChIKeyROUGKVULNXLNIA-UHFFFAOYSA-N
MW252.36 g/mol
LogP2.16
Rot. Bonds5

About 5-N-(2-methoxycyclopentyl)-3-methyl-1-propylpyrazole-4,5-diamine

5-N-(2-methoxycyclopentyl)-3-methyl-1-propylpyrazole-4,5-diamine (PubChem CID 66029779) has the molecular formula C13H24N4O and a molecular weight of 252.36 g/mol. Its IUPAC name is 5-N-(2-methoxycyclopentyl)-3-methyl-1-propylpyrazole-4,5-diamine.

Molecular Properties

Compound Name5-N-(2-methoxycyclopentyl)-3-methyl-1-propylpyrazole-4,5-diamine
PubChem CID66029779
Molecular FormulaC13H24N4O
Molecular Weight252.36 g/mol
Exact Mass252.20
IUPAC Name5-N-(2-methoxycyclopentyl)-3-methyl-1-propylpyrazole-4,5-diamine
SMILESCCCn1nc(C)c(N)c1NC1CCCC1OC
InChIInChI=1S/C13H24N4O/c1-4-8-17-13(12(14)9(2)16-17)15-10-6-5-7-11(10)18-3/h10-11,15H,4-8,14H2,1-3H3
InChIKeyROUGKVULNXLNIA-UHFFFAOYSA-N
XLogP2.16
TPSA65.10 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 52.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-methyl-5-N-(2-methylcyclohexyl)-1-propylpyrazole-4,5-diamine
CID 66028566
3-methyl-5-N-(4-methylcyclohexyl)-1-propylpyrazole-4,5-diamine
CID 66027024
5-N-(2,3-dimethylcyclopentyl)-3-methyl-1-propylpyrazole-4,5-diamine
CID 66029219
3-[(4-amino-3-methyl-1-propylpyrazol-5-yl)amino]cyclobutan-1-ol
CID 66029998
1-ethyl-3-methyl-5-N-(2-methylsulfanylcyclopentyl)pyrazole-4,5-diamine
CID 114121291
5-cyclopentyloxy-3-methyl-1-propylpyrazol-4-amine
CID 66029227
5-N-(3-cyclopentylpropyl)-3-methyl-1-propylpyrazole-4,5-diamine
CID 106007196
3-methyl-5-N-(1-methylcyclopentyl)-1-propylpyrazole-4,5-diamine
CID 66029174
3-N-(2-methoxycyclopentyl)-1-methylpyrazole-3,4-diamine
CID 103078379
5-[[(4-amino-3-methyl-1-propylpyrazol-5-yl)amino]methyl]pyrrolidin-2-one
CID 66027289
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

Frequently Asked Questions

What is the IUPAC name of 5-N-(2-methoxycyclopentyl)-3-methyl-1-propylpyrazole-4,5-diamine?
The IUPAC name of 5-N-(2-methoxycyclopentyl)-3-methyl-1-propylpyrazole-4,5-diamine (CID 66029779) is 5-N-(2-methoxycyclopentyl)-3-methyl-1-propylpyrazole-4,5-diamine.
What is the SMILES notation for 5-N-(2-methoxycyclopentyl)-3-methyl-1-propylpyrazole-4,5-diamine?
The canonical SMILES for 5-N-(2-methoxycyclopentyl)-3-methyl-1-propylpyrazole-4,5-diamine is CCCn1nc(C)c(N)c1NC1CCCC1OC.
What is the InChIKey of 5-N-(2-methoxycyclopentyl)-3-methyl-1-propylpyrazole-4,5-diamine?
The InChIKey is ROUGKVULNXLNIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N4O/c1-4-8-17-13(12(14)9(2)16-17)15-10-6-5-7-11(10)18-3/h10-11,15H,4-8,14H2,1-3H3.
What are the key properties of 5-N-(2-methoxycyclopentyl)-3-methyl-1-propylpyrazole-4,5-diamine?
5-N-(2-methoxycyclopentyl)-3-methyl-1-propylpyrazole-4,5-diamine has a molecular weight of 252.36 g/mol, XLogP of 2.16, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-(2-methoxycyclopentyl)-3-methyl-1-propylpyrazole-4,5-diamine is sourced from PubChem (CID 66029779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).