1-pyridin-3-yl-5-thiophen-2-ylpentan-2-amine

C14H18N2S — CID 105179968

IUPAC1-pyridin-3-yl-5-thiophen-2-ylpentan-2-amine
SMILESNC(CCCc1cccs1)Cc1cccnc1
InChIInChI=1S/C14H18N2S/c15-13(10-12-4-2-8-16-11-12)5-1-6-14-7-3-9-17-14/h2-4,7-9,11,13H,1,5-6,10,15H2
InChIKeyILGOXFFUIWAWQZ-UHFFFAOYSA-N
MW246.38 g/mol
LogP3.04
Rot. Bonds6

About 1-pyridin-3-yl-5-thiophen-2-ylpentan-2-amine

1-pyridin-3-yl-5-thiophen-2-ylpentan-2-amine (PubChem CID 105179968) has the molecular formula C14H18N2S and a molecular weight of 246.38 g/mol. Its IUPAC name is 1-pyridin-3-yl-5-thiophen-2-ylpentan-2-amine.

Molecular Properties

Compound Name1-pyridin-3-yl-5-thiophen-2-ylpentan-2-amine
PubChem CID105179968
Molecular FormulaC14H18N2S
Molecular Weight246.38 g/mol
Exact Mass246.12
IUPAC Name1-pyridin-3-yl-5-thiophen-2-ylpentan-2-amine
SMILESNC(CCCc1cccs1)Cc1cccnc1
InChIInChI=1S/C14H18N2S/c15-13(10-12-4-2-8-16-11-12)5-1-6-14-7-3-9-17-14/h2-4,7-9,11,13H,1,5-6,10,15H2
InChIKeyILGOXFFUIWAWQZ-UHFFFAOYSA-N
XLogP3.04
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.38
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-pyridin-3-yl-5-thiophen-2-ylpentan-2-ol
CID 105125071
(1-pyridin-3-yl-5-thiophen-2-ylpentan-2-yl)hydrazine
CID 105333745
1-(1,3-thiazol-2-yl)-5-thiophen-2-ylpentan-2-amine
CID 105169170
1-pyridin-3-ylundecan-2-amine
CID 62603230
1-naphthalen-2-yl-5-thiophen-2-ylpentan-2-amine
CID 63526837
1-(2-bromophenyl)-5-thiophen-2-ylpentan-2-amine
CID 105087550
1-pyridin-4-yl-5-thiophen-2-ylpentan-2-ol
CID 66460697
1-N,1-N-dimethyl-4-pyridin-3-ylbutane-1,3-diamine
CID 104736690
(2S)-1-pyridin-3-ylbutan-2-amine
CID 93246137
1-(2,3-dichlorophenyl)-5-thiophen-2-ylpentan-2-amine
CID 107312356
4-(2-methylpyrazol-3-yl)-1-pyridin-3-ylbutan-2-amine
CID 103009787
1-(2-chloro-4-fluorophenyl)-5-thiophen-2-ylpentan-2-amine
CID 105133282

Frequently Asked Questions

What is the IUPAC name of 1-pyridin-3-yl-5-thiophen-2-ylpentan-2-amine?
The IUPAC name of 1-pyridin-3-yl-5-thiophen-2-ylpentan-2-amine (CID 105179968) is 1-pyridin-3-yl-5-thiophen-2-ylpentan-2-amine.
What is the SMILES notation for 1-pyridin-3-yl-5-thiophen-2-ylpentan-2-amine?
The canonical SMILES for 1-pyridin-3-yl-5-thiophen-2-ylpentan-2-amine is NC(CCCc1cccs1)Cc1cccnc1.
What is the InChIKey of 1-pyridin-3-yl-5-thiophen-2-ylpentan-2-amine?
The InChIKey is ILGOXFFUIWAWQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2S/c15-13(10-12-4-2-8-16-11-12)5-1-6-14-7-3-9-17-14/h2-4,7-9,11,13H,1,5-6,10,15H2.
What are the key properties of 1-pyridin-3-yl-5-thiophen-2-ylpentan-2-amine?
1-pyridin-3-yl-5-thiophen-2-ylpentan-2-amine has a molecular weight of 246.38 g/mol, XLogP of 3.04, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-pyridin-3-yl-5-thiophen-2-ylpentan-2-amine is sourced from PubChem (CID 105179968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).