2-methyl-2-piperidin-3-yl-N-(thiophen-2-ylmethyl)propan-1-amine

C14H24N2S — CID 83199653

IUPAC2-methyl-2-piperidin-3-yl-N-(thiophen-2-ylmethyl)propan-1-amine
SMILESCC(C)(CNCc1cccs1)C1CCCNC1
InChIInChI=1S/C14H24N2S/c1-14(2,12-5-3-7-15-9-12)11-16-10-13-6-4-8-17-13/h4,6,8,12,15-16H,3,5,7,9-11H2,1-2H3
InChIKeyBXDWBAZOMRBGNS-UHFFFAOYSA-N
MW252.43 g/mol
LogP2.86
Rot. Bonds5

About 2-methyl-2-piperidin-3-yl-N-(thiophen-2-ylmethyl)propan-1-amine

2-methyl-2-piperidin-3-yl-N-(thiophen-2-ylmethyl)propan-1-amine (PubChem CID 83199653) has the molecular formula C14H24N2S and a molecular weight of 252.43 g/mol. Its IUPAC name is 2-methyl-2-piperidin-3-yl-N-(thiophen-2-ylmethyl)propan-1-amine.

Molecular Properties

Compound Name2-methyl-2-piperidin-3-yl-N-(thiophen-2-ylmethyl)propan-1-amine
PubChem CID83199653
Molecular FormulaC14H24N2S
Molecular Weight252.43 g/mol
Exact Mass252.17
IUPAC Name2-methyl-2-piperidin-3-yl-N-(thiophen-2-ylmethyl)propan-1-amine
SMILESCC(C)(CNCc1cccs1)C1CCCNC1
InChIInChI=1S/C14H24N2S/c1-14(2,12-5-3-7-15-9-12)11-16-10-13-6-4-8-17-13/h4,6,8,12,15-16H,3,5,7,9-11H2,1-2H3
InChIKeyBXDWBAZOMRBGNS-UHFFFAOYSA-N
XLogP2.86
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.43
LogP ≤ 52.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-piperidin-3-yl-N-(thiophen-2-ylmethyl)butan-1-amine
CID 81044233
2,2-dimethyl-N-(thiophen-2-ylmethyl)propan-1-amine
CID 21304833
2-methyl-2-piperidin-3-yl-N-propylpropan-1-amine
CID 83199931
2-thiophen-2-ylethyl 2-methyl-2-piperidin-3-ylpropanoate
CID 83197142
5-(2-piperidin-3-ylpropan-2-yl)-3-(thiophen-2-ylmethyl)-1,2,4-oxadiazole
CID 83197748
(3R)-N-(thiophen-2-ylmethyl)piperidine-3-carboxamide
CID 81123819
2,3,3-trimethyl-N-(2-methyl-2-piperidin-3-ylpropyl)butan-1-amine
CID 83200092
N-(2-methoxyethyl)-2-methyl-2-piperidin-3-ylpropan-1-amine
CID 83199662
N-(2-methyl-2-piperidin-3-ylpropyl)cyclopropanamine
CID 83200198
3-chloro-2,2-dimethyl-N-(thiophen-2-ylmethyl)propan-1-amine
CID 115363553
2-methyl-N-[(2-methyloxolan-2-yl)methyl]-2-piperidin-3-ylpropan-1-amine
CID 83198491
2-(azetidin-3-yl)-N-(thiophen-2-ylmethyl)ethanamine
CID 116679496

Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-piperidin-3-yl-N-(thiophen-2-ylmethyl)propan-1-amine?
The IUPAC name of 2-methyl-2-piperidin-3-yl-N-(thiophen-2-ylmethyl)propan-1-amine (CID 83199653) is 2-methyl-2-piperidin-3-yl-N-(thiophen-2-ylmethyl)propan-1-amine.
What is the SMILES notation for 2-methyl-2-piperidin-3-yl-N-(thiophen-2-ylmethyl)propan-1-amine?
The canonical SMILES for 2-methyl-2-piperidin-3-yl-N-(thiophen-2-ylmethyl)propan-1-amine is CC(C)(CNCc1cccs1)C1CCCNC1.
What is the InChIKey of 2-methyl-2-piperidin-3-yl-N-(thiophen-2-ylmethyl)propan-1-amine?
The InChIKey is BXDWBAZOMRBGNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2S/c1-14(2,12-5-3-7-15-9-12)11-16-10-13-6-4-8-17-13/h4,6,8,12,15-16H,3,5,7,9-11H2,1-2H3.
What are the key properties of 2-methyl-2-piperidin-3-yl-N-(thiophen-2-ylmethyl)propan-1-amine?
2-methyl-2-piperidin-3-yl-N-(thiophen-2-ylmethyl)propan-1-amine has a molecular weight of 252.43 g/mol, XLogP of 2.86, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-piperidin-3-yl-N-(thiophen-2-ylmethyl)propan-1-amine is sourced from PubChem (CID 83199653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).