[1-(4-amino-1-methyl-3-propylpyrazol-5-yl)piperidin-3-yl]methanol

C13H24N4O — CID 66020017

IUPAC[1-(4-amino-1-methyl-3-propylpyrazol-5-yl)piperidin-3-yl]methanol
SMILESCCCc1nn(C)c(N2CCCC(CO)C2)c1N
InChIInChI=1S/C13H24N4O/c1-3-5-11-12(14)13(16(2)15-11)17-7-4-6-10(8-17)9-18/h10,18H,3-9,14H2,1-2H3
InChIKeyAMNXXDKOOVPMHX-UHFFFAOYSA-N
MW252.36 g/mol
LogP1.16
Rot. Bonds4

About [1-(4-amino-1-methyl-3-propylpyrazol-5-yl)piperidin-3-yl]methanol

[1-(4-amino-1-methyl-3-propylpyrazol-5-yl)piperidin-3-yl]methanol (PubChem CID 66020017) has the molecular formula C13H24N4O and a molecular weight of 252.36 g/mol. Its IUPAC name is [1-(4-amino-1-methyl-3-propylpyrazol-5-yl)piperidin-3-yl]methanol.

Molecular Properties

Compound Name[1-(4-amino-1-methyl-3-propylpyrazol-5-yl)piperidin-3-yl]methanol
PubChem CID66020017
Molecular FormulaC13H24N4O
Molecular Weight252.36 g/mol
Exact Mass252.20
IUPAC Name[1-(4-amino-1-methyl-3-propylpyrazol-5-yl)piperidin-3-yl]methanol
SMILESCCCc1nn(C)c(N2CCCC(CO)C2)c1N
InChIInChI=1S/C13H24N4O/c1-3-5-11-12(14)13(16(2)15-11)17-7-4-6-10(8-17)9-18/h10,18H,3-9,14H2,1-2H3
InChIKeyAMNXXDKOOVPMHX-UHFFFAOYSA-N
XLogP1.16
TPSA67.31 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 51.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-[3-(methoxymethyl)pyrrolidin-1-yl]-1-methyl-3-propylpyrazol-4-amine
CID 66018904
5-(3-ethyl-4-methylpiperazin-1-yl)-1-methyl-3-propylpyrazol-4-amine
CID 66018899
5-[4-(cyclopropylmethyl)piperazin-1-yl]-1-methyl-3-propylpyrazol-4-amine
CID 66018866
1-methyl-5-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)-3-propylpyrazol-4-amine
CID 79174452
1-methyl-5-(4-methyl-1,4-diazepan-1-yl)-3-propylpyrazol-4-amine
CID 66018437
5-(3-ethylpiperidin-1-yl)-1,3-dimethylpyrazol-4-amine
CID 43584190
1-methyl-5-(2-methyl-1,4-oxazepan-4-yl)-3-propylpyrazol-4-amine
CID 66018504
[1-(4-amino-1-ethyl-3-methylpyrazol-5-yl)piperidin-3-yl]methanol
CID 66012620
[1-[4-(aminomethyl)-1,3-dimethylpyrazol-5-yl]piperidin-3-yl]methanol
CID 43590482
1-[4-(4-amino-1-methyl-3-propylpyrazol-5-yl)piperazin-1-yl]ethanone
CID 66018435
3-ethyl-1-methyl-5-(4-propylazepan-1-yl)pyrazol-4-amine
CID 66013850
[4-(4-amino-1-methyl-3-propylpyrazol-5-yl)-6-methylmorpholin-2-yl]methanol
CID 102931918

Frequently Asked Questions

What is the IUPAC name of [1-(4-amino-1-methyl-3-propylpyrazol-5-yl)piperidin-3-yl]methanol?
The IUPAC name of [1-(4-amino-1-methyl-3-propylpyrazol-5-yl)piperidin-3-yl]methanol (CID 66020017) is [1-(4-amino-1-methyl-3-propylpyrazol-5-yl)piperidin-3-yl]methanol.
What is the SMILES notation for [1-(4-amino-1-methyl-3-propylpyrazol-5-yl)piperidin-3-yl]methanol?
The canonical SMILES for [1-(4-amino-1-methyl-3-propylpyrazol-5-yl)piperidin-3-yl]methanol is CCCc1nn(C)c(N2CCCC(CO)C2)c1N.
What is the InChIKey of [1-(4-amino-1-methyl-3-propylpyrazol-5-yl)piperidin-3-yl]methanol?
The InChIKey is AMNXXDKOOVPMHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N4O/c1-3-5-11-12(14)13(16(2)15-11)17-7-4-6-10(8-17)9-18/h10,18H,3-9,14H2,1-2H3.
What are the key properties of [1-(4-amino-1-methyl-3-propylpyrazol-5-yl)piperidin-3-yl]methanol?
[1-(4-amino-1-methyl-3-propylpyrazol-5-yl)piperidin-3-yl]methanol has a molecular weight of 252.36 g/mol, XLogP of 1.16, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-amino-1-methyl-3-propylpyrazol-5-yl)piperidin-3-yl]methanol is sourced from PubChem (CID 66020017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).