1-[1-(4-methylpentyl)piperidin-4-yl]pyrazol-3-amine

C14H26N4 — CID 107109773

IUPAC1-[1-(4-methylpentyl)piperidin-4-yl]pyrazol-3-amine
SMILESCC(C)CCCN1CCC(n2ccc(N)n2)CC1
InChIInChI=1S/C14H26N4/c1-12(2)4-3-8-17-9-5-13(6-10-17)18-11-7-14(15)16-18/h7,11-13H,3-6,8-10H2,1-2H3,(H2,15,16)
InChIKeyCBGXAJKITDBDPC-UHFFFAOYSA-N
MW250.39 g/mol
LogP2.54
Rot. Bonds5

About 1-[1-(4-methylpentyl)piperidin-4-yl]pyrazol-3-amine

1-[1-(4-methylpentyl)piperidin-4-yl]pyrazol-3-amine (PubChem CID 107109773) has the molecular formula C14H26N4 and a molecular weight of 250.39 g/mol. Its IUPAC name is 1-[1-(4-methylpentyl)piperidin-4-yl]pyrazol-3-amine.

Molecular Properties

Compound Name1-[1-(4-methylpentyl)piperidin-4-yl]pyrazol-3-amine
PubChem CID107109773
Molecular FormulaC14H26N4
Molecular Weight250.39 g/mol
Exact Mass250.22
IUPAC Name1-[1-(4-methylpentyl)piperidin-4-yl]pyrazol-3-amine
SMILESCC(C)CCCN1CCC(n2ccc(N)n2)CC1
InChIInChI=1S/C14H26N4/c1-12(2)4-3-8-17-9-5-13(6-10-17)18-11-7-14(15)16-18/h7,11-13H,3-6,8-10H2,1-2H3,(H2,15,16)
InChIKeyCBGXAJKITDBDPC-UHFFFAOYSA-N
XLogP2.54
TPSA47.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(1-nonylpiperidin-4-yl)pyrazol-3-amine
CID 107109618
1-(1-heptylpiperidin-4-yl)pyrazol-3-amine
CID 107109683
1-[1-(2-propan-2-ylsulfonylethyl)piperidin-4-yl]pyrazol-3-amine
CID 107109951
1-[1-(2-butoxyethyl)piperidin-4-yl]pyrazol-3-amine
CID 107110055
1-[1-(2-cyclopropylethyl)piperidin-4-yl]pyrazol-3-amine
CID 107109993
2-[4-(3-aminopyrazol-1-yl)piperidin-1-yl]-N-methyl-N-propan-2-ylacetamide
CID 107110032
4-[4-(3-aminopyrazol-1-yl)piperidin-1-yl]-2-methylbutan-2-ol
CID 107109591
1-[1-[3-(oxolan-2-yl)propyl]piperidin-4-yl]pyrazol-3-amine
CID 107109665
1-[2-[4-(3-aminopyrazol-1-yl)piperidin-1-yl]ethyl]imidazolidin-2-one
CID 107109700
2-[4-(3-aminopyrazol-1-yl)piperidin-1-yl]-N-ethyl-N-methylacetamide
CID 107109646
1-[1-(2-thiophen-2-ylethyl)piperidin-4-yl]pyrazol-3-amine
CID 107109728
1-[1-[(5-methyloxolan-2-yl)methyl]piperidin-4-yl]pyrazol-3-amine
CID 107110097

Frequently Asked Questions

What is the IUPAC name of 1-[1-(4-methylpentyl)piperidin-4-yl]pyrazol-3-amine?
The IUPAC name of 1-[1-(4-methylpentyl)piperidin-4-yl]pyrazol-3-amine (CID 107109773) is 1-[1-(4-methylpentyl)piperidin-4-yl]pyrazol-3-amine.
What is the SMILES notation for 1-[1-(4-methylpentyl)piperidin-4-yl]pyrazol-3-amine?
The canonical SMILES for 1-[1-(4-methylpentyl)piperidin-4-yl]pyrazol-3-amine is CC(C)CCCN1CCC(n2ccc(N)n2)CC1.
What is the InChIKey of 1-[1-(4-methylpentyl)piperidin-4-yl]pyrazol-3-amine?
The InChIKey is CBGXAJKITDBDPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4/c1-12(2)4-3-8-17-9-5-13(6-10-17)18-11-7-14(15)16-18/h7,11-13H,3-6,8-10H2,1-2H3,(H2,15,16).
What are the key properties of 1-[1-(4-methylpentyl)piperidin-4-yl]pyrazol-3-amine?
1-[1-(4-methylpentyl)piperidin-4-yl]pyrazol-3-amine has a molecular weight of 250.39 g/mol, XLogP of 2.54, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(4-methylpentyl)piperidin-4-yl]pyrazol-3-amine is sourced from PubChem (CID 107109773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).