N,3-dimethyl-3-piperidin-1-yl-1-thiophen-2-ylpentan-2-amine

C16H28N2S — CID 79065597

IUPACN,3-dimethyl-3-piperidin-1-yl-1-thiophen-2-ylpentan-2-amine
SMILESCCC(C)(C(Cc1cccs1)NC)N1CCCCC1
InChIInChI=1S/C16H28N2S/c1-4-16(2,18-10-6-5-7-11-18)15(17-3)13-14-9-8-12-19-14/h8-9,12,15,17H,4-7,10-11,13H2,1-3H3
InChIKeyJVEHTRHPIKKGQH-UHFFFAOYSA-N
MW280.48 g/mol
LogP3.53
Rot. Bonds6

About N,3-dimethyl-3-piperidin-1-yl-1-thiophen-2-ylpentan-2-amine

N,3-dimethyl-3-piperidin-1-yl-1-thiophen-2-ylpentan-2-amine (PubChem CID 79065597) has the molecular formula C16H28N2S and a molecular weight of 280.48 g/mol. Its IUPAC name is N,3-dimethyl-3-piperidin-1-yl-1-thiophen-2-ylpentan-2-amine.

Molecular Properties

Compound NameN,3-dimethyl-3-piperidin-1-yl-1-thiophen-2-ylpentan-2-amine
PubChem CID79065597
Molecular FormulaC16H28N2S
Molecular Weight280.48 g/mol
Exact Mass280.20
IUPAC NameN,3-dimethyl-3-piperidin-1-yl-1-thiophen-2-ylpentan-2-amine
SMILESCCC(C)(C(Cc1cccs1)NC)N1CCCCC1
InChIInChI=1S/C16H28N2S/c1-4-16(2,18-10-6-5-7-11-18)15(17-3)13-14-9-8-12-19-14/h8-9,12,15,17H,4-7,10-11,13H2,1-3H3
InChIKeyJVEHTRHPIKKGQH-UHFFFAOYSA-N
XLogP3.53
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.48
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-methyl-3-pyrrolidin-1-yl-1-thiophen-2-ylpentan-2-amine
CID 79068401
1-(5-ethylthiophen-2-yl)-N,3-dimethyl-3-pyrrolidin-1-ylpentan-2-amine
CID 79068652
(3-methyl-3-piperidin-1-yl-1-thiophen-2-ylbutan-2-yl)hydrazine
CID 105239963
1-(4-bromophenyl)-N,3-dimethyl-3-piperidin-1-ylpentan-2-amine
CID 79060487
N,4-dimethyl-4-piperidin-1-ylhexan-3-amine
CID 79065370
N,3,7-trimethyl-3-piperidin-1-yloctan-4-amine
CID 79065446
N,3-dimethyl-1-(1-methylpyrazol-4-yl)-3-pyrrolidin-1-ylpentan-2-amine
CID 79068880
4-methyl-4-piperidin-1-yl-N-propyl-1-thiophen-2-ylpentan-3-amine
CID 79052192
1-(2-fluorophenyl)-N,3-dimethyl-3-morpholin-4-ylpentan-2-amine
CID 79057627
2-methyl-2-piperidin-1-yl-3-thiophen-2-ylpropanenitrile
CID 82083214
3-(azepan-1-yl)-1-(5-bromothiophen-2-yl)-N,3-dimethylbutan-2-amine
CID 79052539
4-methyl-4-pyrrolidin-1-yl-1-thiophen-2-ylpentan-3-amine
CID 79056548

Frequently Asked Questions

What is the IUPAC name of N,3-dimethyl-3-piperidin-1-yl-1-thiophen-2-ylpentan-2-amine?
The IUPAC name of N,3-dimethyl-3-piperidin-1-yl-1-thiophen-2-ylpentan-2-amine (CID 79065597) is N,3-dimethyl-3-piperidin-1-yl-1-thiophen-2-ylpentan-2-amine.
What is the SMILES notation for N,3-dimethyl-3-piperidin-1-yl-1-thiophen-2-ylpentan-2-amine?
The canonical SMILES for N,3-dimethyl-3-piperidin-1-yl-1-thiophen-2-ylpentan-2-amine is CCC(C)(C(Cc1cccs1)NC)N1CCCCC1.
What is the InChIKey of N,3-dimethyl-3-piperidin-1-yl-1-thiophen-2-ylpentan-2-amine?
The InChIKey is JVEHTRHPIKKGQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2S/c1-4-16(2,18-10-6-5-7-11-18)15(17-3)13-14-9-8-12-19-14/h8-9,12,15,17H,4-7,10-11,13H2,1-3H3.
What are the key properties of N,3-dimethyl-3-piperidin-1-yl-1-thiophen-2-ylpentan-2-amine?
N,3-dimethyl-3-piperidin-1-yl-1-thiophen-2-ylpentan-2-amine has a molecular weight of 280.48 g/mol, XLogP of 3.53, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,3-dimethyl-3-piperidin-1-yl-1-thiophen-2-ylpentan-2-amine is sourced from PubChem (CID 79065597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).