1-[1-[(2-ethyl-5-methylpyrazol-3-yl)methyl]piperidin-4-yl]pyrazol-3-amine

C15H24N6 — CID 107109996

IUPAC1-[1-[(2-ethyl-5-methylpyrazol-3-yl)methyl]piperidin-4-yl]pyrazol-3-amine
SMILESCCn1nc(C)cc1CN1CCC(n2ccc(N)n2)CC1
InChIInChI=1S/C15H24N6/c1-3-20-14(10-12(2)17-20)11-19-7-4-13(5-8-19)21-9-6-15(16)18-21/h6,9-10,13H,3-5,7-8,11H2,1-2H3,(H2,16,18)
InChIKeyVZPKKTMHFBIZQK-UHFFFAOYSA-N
MW288.40 g/mol
LogP1.83
Rot. Bonds4

About 1-[1-[(2-ethyl-5-methylpyrazol-3-yl)methyl]piperidin-4-yl]pyrazol-3-amine

1-[1-[(2-ethyl-5-methylpyrazol-3-yl)methyl]piperidin-4-yl]pyrazol-3-amine (PubChem CID 107109996) has the molecular formula C15H24N6 and a molecular weight of 288.40 g/mol. Its IUPAC name is 1-[1-[(2-ethyl-5-methylpyrazol-3-yl)methyl]piperidin-4-yl]pyrazol-3-amine.

Molecular Properties

Compound Name1-[1-[(2-ethyl-5-methylpyrazol-3-yl)methyl]piperidin-4-yl]pyrazol-3-amine
PubChem CID107109996
Molecular FormulaC15H24N6
Molecular Weight288.40 g/mol
Exact Mass288.21
IUPAC Name1-[1-[(2-ethyl-5-methylpyrazol-3-yl)methyl]piperidin-4-yl]pyrazol-3-amine
SMILESCCn1nc(C)cc1CN1CCC(n2ccc(N)n2)CC1
InChIInChI=1S/C15H24N6/c1-3-20-14(10-12(2)17-20)11-19-7-4-13(5-8-19)21-9-6-15(16)18-21/h6,9-10,13H,3-5,7-8,11H2,1-2H3,(H2,16,18)
InChIKeyVZPKKTMHFBIZQK-UHFFFAOYSA-N
XLogP1.83
TPSA64.90 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.40
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

1-[1-[(3,4-dimethylphenyl)methyl]piperidin-4-yl]pyrazol-3-amine
CID 107109823
1-[(2-ethyl-5-methylpyrazol-3-yl)methyl]piperazine
CID 25248518
1-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]pyrazol-3-amine
CID 107109946
1-(1-heptylpiperidin-4-yl)pyrazol-3-amine
CID 107109683
1-(1-nonylpiperidin-4-yl)pyrazol-3-amine
CID 107109618
1-[1-(2-cyclopropylethyl)piperidin-4-yl]pyrazol-3-amine
CID 107109993
1-[1-[(5-methyloxolan-2-yl)methyl]piperidin-4-yl]pyrazol-3-amine
CID 107110097
1-[1-[(3-bromo-5-fluorophenyl)methyl]piperidin-4-yl]pyrazol-3-amine
CID 107109920
1-[1-(2-butoxyethyl)piperidin-4-yl]pyrazol-3-amine
CID 107110055
1-[(2-ethyl-5-methylpyrazol-3-yl)methyl]-4-methylpiperidin-4-ol
CID 81115265
1-[1-(4-methylpentyl)piperidin-4-yl]pyrazol-3-amine
CID 107109773
4-[4-(3-aminopyrazol-1-yl)piperidin-1-yl]-2-methylbutan-2-ol
CID 107109591

Frequently Asked Questions

What is the IUPAC name of 1-[1-[(2-ethyl-5-methylpyrazol-3-yl)methyl]piperidin-4-yl]pyrazol-3-amine?
The IUPAC name of 1-[1-[(2-ethyl-5-methylpyrazol-3-yl)methyl]piperidin-4-yl]pyrazol-3-amine (CID 107109996) is 1-[1-[(2-ethyl-5-methylpyrazol-3-yl)methyl]piperidin-4-yl]pyrazol-3-amine.
What is the SMILES notation for 1-[1-[(2-ethyl-5-methylpyrazol-3-yl)methyl]piperidin-4-yl]pyrazol-3-amine?
The canonical SMILES for 1-[1-[(2-ethyl-5-methylpyrazol-3-yl)methyl]piperidin-4-yl]pyrazol-3-amine is CCn1nc(C)cc1CN1CCC(n2ccc(N)n2)CC1.
What is the InChIKey of 1-[1-[(2-ethyl-5-methylpyrazol-3-yl)methyl]piperidin-4-yl]pyrazol-3-amine?
The InChIKey is VZPKKTMHFBIZQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N6/c1-3-20-14(10-12(2)17-20)11-19-7-4-13(5-8-19)21-9-6-15(16)18-21/h6,9-10,13H,3-5,7-8,11H2,1-2H3,(H2,16,18).
What are the key properties of 1-[1-[(2-ethyl-5-methylpyrazol-3-yl)methyl]piperidin-4-yl]pyrazol-3-amine?
1-[1-[(2-ethyl-5-methylpyrazol-3-yl)methyl]piperidin-4-yl]pyrazol-3-amine has a molecular weight of 288.40 g/mol, XLogP of 1.83, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[(2-ethyl-5-methylpyrazol-3-yl)methyl]piperidin-4-yl]pyrazol-3-amine is sourced from PubChem (CID 107109996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).