N-[(2-methylpiperidin-2-yl)methyl]-N-(thiophen-2-ylmethyl)propan-2-amine

C15H26N2S — CID 104594909

IUPACN-[(2-methylpiperidin-2-yl)methyl]-N-(thiophen-2-ylmethyl)propan-2-amine
SMILESCC(C)N(Cc1cccs1)CC1(C)CCCCN1
InChIInChI=1S/C15H26N2S/c1-13(2)17(11-14-7-6-10-18-14)12-15(3)8-4-5-9-16-15/h6-7,10,13,16H,4-5,8-9,11-12H2,1-3H3
InChIKeyHXJDCYMTUYFSEX-UHFFFAOYSA-N
MW266.45 g/mol
LogP3.49
Rot. Bonds5

About N-[(2-methylpiperidin-2-yl)methyl]-N-(thiophen-2-ylmethyl)propan-2-amine

N-[(2-methylpiperidin-2-yl)methyl]-N-(thiophen-2-ylmethyl)propan-2-amine (PubChem CID 104594909) has the molecular formula C15H26N2S and a molecular weight of 266.45 g/mol. Its IUPAC name is N-[(2-methylpiperidin-2-yl)methyl]-N-(thiophen-2-ylmethyl)propan-2-amine.

Molecular Properties

Compound NameN-[(2-methylpiperidin-2-yl)methyl]-N-(thiophen-2-ylmethyl)propan-2-amine
PubChem CID104594909
Molecular FormulaC15H26N2S
Molecular Weight266.45 g/mol
Exact Mass266.18
IUPAC NameN-[(2-methylpiperidin-2-yl)methyl]-N-(thiophen-2-ylmethyl)propan-2-amine
SMILESCC(C)N(Cc1cccs1)CC1(C)CCCCN1
InChIInChI=1S/C15H26N2S/c1-13(2)17(11-14-7-6-10-18-14)12-15(3)8-4-5-9-16-15/h6-7,10,13,16H,4-5,8-9,11-12H2,1-3H3
InChIKeyHXJDCYMTUYFSEX-UHFFFAOYSA-N
XLogP3.49
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.45
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(3-methylpyrrolidin-3-yl)methyl]-N-(thiophen-2-ylmethyl)propan-2-amine
CID 63142751
1-[[propan-2-yl(thiophen-2-ylmethyl)amino]methyl]cyclobutan-1-amine
CID 81171454
2-propan-2-yl-2-(2-thiophen-2-ylethyl)azepane
CID 79119111
N-[(2-methylpiperidin-2-yl)methyl]-1-thiophen-2-ylmethanamine
CID 104594809
3-methyl-N-propan-2-yl-N-(thiophen-2-ylmethyl)piperidine-3-carboxamide
CID 63135259
2-[1-[[propan-2-yl(thiophen-2-ylmethyl)amino]methyl]cyclopropyl]acetonitrile
CID 65494867
N,2-dimethyl-N-(thiophen-2-ylmethyl)piperidine-2-carboxamide
CID 113368557
N-[(2-methylpiperidin-2-yl)methyl]-N-(2,2,2-trifluoroethyl)propan-2-amine
CID 104594957
N-[(2-methylpiperidin-2-yl)methyl]-N-propan-2-ylpentan-1-amine
CID 104594932
N-methyl-N-[(2-methylpiperidin-2-yl)methyl]propan-2-amine
CID 104594706
N-propan-2-yl-2-propyl-N-(thiophen-2-ylmethyl)pyrrolidine-2-carboxamide
CID 106974977
4-[[propan-2-yl(thiophen-2-ylmethyl)amino]methyl]benzonitrile
CID 61451334

Frequently Asked Questions

What is the IUPAC name of N-[(2-methylpiperidin-2-yl)methyl]-N-(thiophen-2-ylmethyl)propan-2-amine?
The IUPAC name of N-[(2-methylpiperidin-2-yl)methyl]-N-(thiophen-2-ylmethyl)propan-2-amine (CID 104594909) is N-[(2-methylpiperidin-2-yl)methyl]-N-(thiophen-2-ylmethyl)propan-2-amine.
What is the SMILES notation for N-[(2-methylpiperidin-2-yl)methyl]-N-(thiophen-2-ylmethyl)propan-2-amine?
The canonical SMILES for N-[(2-methylpiperidin-2-yl)methyl]-N-(thiophen-2-ylmethyl)propan-2-amine is CC(C)N(Cc1cccs1)CC1(C)CCCCN1.
What is the InChIKey of N-[(2-methylpiperidin-2-yl)methyl]-N-(thiophen-2-ylmethyl)propan-2-amine?
The InChIKey is HXJDCYMTUYFSEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2S/c1-13(2)17(11-14-7-6-10-18-14)12-15(3)8-4-5-9-16-15/h6-7,10,13,16H,4-5,8-9,11-12H2,1-3H3.
What are the key properties of N-[(2-methylpiperidin-2-yl)methyl]-N-(thiophen-2-ylmethyl)propan-2-amine?
N-[(2-methylpiperidin-2-yl)methyl]-N-(thiophen-2-ylmethyl)propan-2-amine has a molecular weight of 266.45 g/mol, XLogP of 3.49, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methylpiperidin-2-yl)methyl]-N-(thiophen-2-ylmethyl)propan-2-amine is sourced from PubChem (CID 104594909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).