5-methyl-3-piperidin-4-yl-1H-pyrazol-4-amine

C9H16N4 — CID 165446837

IUPAC5-methyl-3-piperidin-4-yl-1H-pyrazol-4-amine
SMILESCc1[nH]nc(C2CCNCC2)c1N
InChIInChI=1S/C9H16N4/c1-6-8(10)9(13-12-6)7-2-4-11-5-3-7/h7,11H,2-5,10H2,1H3,(H,12,13)
InChIKeyIOFLDBRCUOZXNV-UHFFFAOYSA-N
MW180.25 g/mol
LogP0.77
Rot. Bonds1

About 5-methyl-3-piperidin-4-yl-1H-pyrazol-4-amine

5-methyl-3-piperidin-4-yl-1H-pyrazol-4-amine (PubChem CID 165446837) has the molecular formula C9H16N4 and a molecular weight of 180.25 g/mol. Its IUPAC name is 5-methyl-3-piperidin-4-yl-1H-pyrazol-4-amine.

Molecular Properties

Compound Name5-methyl-3-piperidin-4-yl-1H-pyrazol-4-amine
PubChem CID165446837
Molecular FormulaC9H16N4
Molecular Weight180.25 g/mol
Exact Mass180.14
IUPAC Name5-methyl-3-piperidin-4-yl-1H-pyrazol-4-amine
SMILESCc1[nH]nc(C2CCNCC2)c1N
InChIInChI=1S/C9H16N4/c1-6-8(10)9(13-12-6)7-2-4-11-5-3-7/h7,11H,2-5,10H2,1H3,(H,12,13)
InChIKeyIOFLDBRCUOZXNV-UHFFFAOYSA-N
XLogP0.77
TPSA66.73 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 50.77
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

5-methyl-3-(3-methylcyclobutyl)-1H-pyrazol-4-amine
CID 119055015
4-(5-methyl-2-propan-2-yl-1H-imidazol-4-yl)piperidine
CID 105461163
4-(bromomethyl)-3-cyclopropyl-5-methyl-1H-pyrazole
CID 121211442
(3-cyclopentyl-5-methyl-1H-pyrazol-4-yl)methanol
CID 121212716
N-(4,5-dimethyl-1H-pyrazol-3-yl)piperidin-4-amine
CID 114698094
4-(chloromethyl)-3-cyclopentyl-5-methyl-1H-pyrazole
CID 121212728
4-(1,5-dimethylimidazol-4-yl)piperidine
CID 84657143
4-cyclopentyl-5-methyl-1H-pyrazol-3-amine
CID 83815875
2,4-dimethyl-6-piperidin-4-yl-1,3,5-triazine
CID 82468969
6-chloro-2-piperidin-4-ylpyridin-3-amine
CID 169253686
3,5-dimethyl-7-piperidin-4-yl-[1,2]thiazolo[4,5-d]pyrimidine
CID 82383284
tert-butyl formate;4-(5-methyl-1H-pyrazol-3-yl)piperidine
CID 174800921

Frequently Asked Questions

What is the IUPAC name of 5-methyl-3-piperidin-4-yl-1H-pyrazol-4-amine?
The IUPAC name of 5-methyl-3-piperidin-4-yl-1H-pyrazol-4-amine (CID 165446837) is 5-methyl-3-piperidin-4-yl-1H-pyrazol-4-amine.
What is the SMILES notation for 5-methyl-3-piperidin-4-yl-1H-pyrazol-4-amine?
The canonical SMILES for 5-methyl-3-piperidin-4-yl-1H-pyrazol-4-amine is Cc1[nH]nc(C2CCNCC2)c1N.
What is the InChIKey of 5-methyl-3-piperidin-4-yl-1H-pyrazol-4-amine?
The InChIKey is IOFLDBRCUOZXNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N4/c1-6-8(10)9(13-12-6)7-2-4-11-5-3-7/h7,11H,2-5,10H2,1H3,(H,12,13).
What are the key properties of 5-methyl-3-piperidin-4-yl-1H-pyrazol-4-amine?
5-methyl-3-piperidin-4-yl-1H-pyrazol-4-amine has a molecular weight of 180.25 g/mol, XLogP of 0.77, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-3-piperidin-4-yl-1H-pyrazol-4-amine is sourced from PubChem (CID 165446837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).