1-propan-2-yl-N-(1-thiophen-2-ylethyl)piperidin-4-amine

C14H24N2S — CID 43182947

IUPAC1-propan-2-yl-N-(1-thiophen-2-ylethyl)piperidin-4-amine
SMILESCC(NC1CCN(C(C)C)CC1)c1cccs1
InChIInChI=1S/C14H24N2S/c1-11(2)16-8-6-13(7-9-16)15-12(3)14-5-4-10-17-14/h4-5,10-13,15H,6-9H2,1-3H3
InChIKeyCKIJDHVOFHIFJR-UHFFFAOYSA-N
MW252.43 g/mol
LogP3.27
Rot. Bonds4

About 1-propan-2-yl-N-(1-thiophen-2-ylethyl)piperidin-4-amine

1-propan-2-yl-N-(1-thiophen-2-ylethyl)piperidin-4-amine (PubChem CID 43182947) has the molecular formula C14H24N2S and a molecular weight of 252.43 g/mol. Its IUPAC name is 1-propan-2-yl-N-(1-thiophen-2-ylethyl)piperidin-4-amine.

Molecular Properties

Compound Name1-propan-2-yl-N-(1-thiophen-2-ylethyl)piperidin-4-amine
PubChem CID43182947
Molecular FormulaC14H24N2S
Molecular Weight252.43 g/mol
Exact Mass252.17
IUPAC Name1-propan-2-yl-N-(1-thiophen-2-ylethyl)piperidin-4-amine
SMILESCC(NC1CCN(C(C)C)CC1)c1cccs1
InChIInChI=1S/C14H24N2S/c1-11(2)16-8-6-13(7-9-16)15-12(3)14-5-4-10-17-14/h4-5,10-13,15H,6-9H2,1-3H3
InChIKeyCKIJDHVOFHIFJR-UHFFFAOYSA-N
XLogP3.27
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.43
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[cyclopentyl(thiophen-2-yl)methyl]-1-propan-2-ylpiperidin-4-amine
CID 43740557
1-(2-methylpropyl)-N-(1-thiophen-2-ylethyl)piperidin-4-amine
CID 103775855
N-(1-thiophen-2-ylethyl)cyclohexanamine
CID 25219735
1-pyridin-4-yl-N-(1-thiophen-2-ylethyl)piperidin-4-amine
CID 43343794
N,N-dimethyl-4-[[(1R)-1-thiophen-2-ylethyl]amino]piperidine-1-carboxamide
CID 83261830
1-propan-2-yl-N-(2-thiophen-2-ylpropyl)piperidin-4-amine
CID 75428213
4-(1-thiophen-2-ylethylamino)cyclohexan-1-ol
CID 43193909
cis-(1R,2S)-2-[4-[[(1S)-1-thiophen-2-ylethyl]amino]piperidin-1-yl]cyclohexan-1-ol
CID 129432736
1-propan-2-yl-N-(1-pyridin-4-ylethyl)piperidin-4-amine
CID 43182945
N-[1-(5-ethylthiophen-2-yl)ethyl]-1-propan-2-ylpiperidin-4-amine
CID 54979176
1-propyl-N-[(1S)-1-thiophen-2-ylethyl]azepan-4-amine
CID 81398218
8-methyl-N-[(1R)-1-thiophen-2-ylethyl]-8-azabicyclo[3.2.1]octan-3-amine
CID 81398172

Frequently Asked Questions

What is the IUPAC name of 1-propan-2-yl-N-(1-thiophen-2-ylethyl)piperidin-4-amine?
The IUPAC name of 1-propan-2-yl-N-(1-thiophen-2-ylethyl)piperidin-4-amine (CID 43182947) is 1-propan-2-yl-N-(1-thiophen-2-ylethyl)piperidin-4-amine.
What is the SMILES notation for 1-propan-2-yl-N-(1-thiophen-2-ylethyl)piperidin-4-amine?
The canonical SMILES for 1-propan-2-yl-N-(1-thiophen-2-ylethyl)piperidin-4-amine is CC(NC1CCN(C(C)C)CC1)c1cccs1.
What is the InChIKey of 1-propan-2-yl-N-(1-thiophen-2-ylethyl)piperidin-4-amine?
The InChIKey is CKIJDHVOFHIFJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2S/c1-11(2)16-8-6-13(7-9-16)15-12(3)14-5-4-10-17-14/h4-5,10-13,15H,6-9H2,1-3H3.
What are the key properties of 1-propan-2-yl-N-(1-thiophen-2-ylethyl)piperidin-4-amine?
1-propan-2-yl-N-(1-thiophen-2-ylethyl)piperidin-4-amine has a molecular weight of 252.43 g/mol, XLogP of 3.27, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-propan-2-yl-N-(1-thiophen-2-ylethyl)piperidin-4-amine is sourced from PubChem (CID 43182947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).