1-[1-(2-thiophen-2-ylethyl)piperidin-4-yl]pyrazol-3-amine

C14H20N4S — CID 107109728

IUPAC1-[1-(2-thiophen-2-ylethyl)piperidin-4-yl]pyrazol-3-amine
SMILESNc1ccn(C2CCN(CCc3cccs3)CC2)n1
InChIInChI=1S/C14H20N4S/c15-14-6-10-18(16-14)12-3-7-17(8-4-12)9-5-13-2-1-11-19-13/h1-2,6,10-12H,3-5,7-9H2,(H2,15,16)
InChIKeyLQQISPQRLRSQFH-UHFFFAOYSA-N
MW276.41 g/mol
LogP2.41
Rot. Bonds4

About 1-[1-(2-thiophen-2-ylethyl)piperidin-4-yl]pyrazol-3-amine

1-[1-(2-thiophen-2-ylethyl)piperidin-4-yl]pyrazol-3-amine (PubChem CID 107109728) has the molecular formula C14H20N4S and a molecular weight of 276.41 g/mol. Its IUPAC name is 1-[1-(2-thiophen-2-ylethyl)piperidin-4-yl]pyrazol-3-amine.

Molecular Properties

Compound Name1-[1-(2-thiophen-2-ylethyl)piperidin-4-yl]pyrazol-3-amine
PubChem CID107109728
Molecular FormulaC14H20N4S
Molecular Weight276.41 g/mol
Exact Mass276.14
IUPAC Name1-[1-(2-thiophen-2-ylethyl)piperidin-4-yl]pyrazol-3-amine
SMILESNc1ccn(C2CCN(CCc3cccs3)CC2)n1
InChIInChI=1S/C14H20N4S/c15-14-6-10-18(16-14)12-3-7-17(8-4-12)9-5-13-2-1-11-19-13/h1-2,6,10-12H,3-5,7-9H2,(H2,15,16)
InChIKeyLQQISPQRLRSQFH-UHFFFAOYSA-N
XLogP2.41
TPSA47.08 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.41
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-[1-(2-cyclopropylethyl)piperidin-4-yl]pyrazol-3-amine
CID 107109993
1-(2-thiophen-2-ylethyl)pyrazol-3-amine
CID 63773628
1-(1-nonylpiperidin-4-yl)pyrazol-3-amine
CID 107109618
1-(1-heptylpiperidin-4-yl)pyrazol-3-amine
CID 107109683
1-[1-(4-methylpentyl)piperidin-4-yl]pyrazol-3-amine
CID 107109773
1-(2-thiophen-2-ylethyl)piperidine-4-carbonitrile
CID 62416012
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-[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
1-[1-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)piperidin-4-yl]pyrazol-3-amine
CID 107110082
1-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]pyrazol-3-amine
CID 107109946

Frequently Asked Questions

What is the IUPAC name of 1-[1-(2-thiophen-2-ylethyl)piperidin-4-yl]pyrazol-3-amine?
The IUPAC name of 1-[1-(2-thiophen-2-ylethyl)piperidin-4-yl]pyrazol-3-amine (CID 107109728) is 1-[1-(2-thiophen-2-ylethyl)piperidin-4-yl]pyrazol-3-amine.
What is the SMILES notation for 1-[1-(2-thiophen-2-ylethyl)piperidin-4-yl]pyrazol-3-amine?
The canonical SMILES for 1-[1-(2-thiophen-2-ylethyl)piperidin-4-yl]pyrazol-3-amine is Nc1ccn(C2CCN(CCc3cccs3)CC2)n1.
What is the InChIKey of 1-[1-(2-thiophen-2-ylethyl)piperidin-4-yl]pyrazol-3-amine?
The InChIKey is LQQISPQRLRSQFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4S/c15-14-6-10-18(16-14)12-3-7-17(8-4-12)9-5-13-2-1-11-19-13/h1-2,6,10-12H,3-5,7-9H2,(H2,15,16).
What are the key properties of 1-[1-(2-thiophen-2-ylethyl)piperidin-4-yl]pyrazol-3-amine?
1-[1-(2-thiophen-2-ylethyl)piperidin-4-yl]pyrazol-3-amine has a molecular weight of 276.41 g/mol, XLogP of 2.41, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(2-thiophen-2-ylethyl)piperidin-4-yl]pyrazol-3-amine is sourced from PubChem (CID 107109728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).