N-propyl-1-thiophen-3-ylheptan-3-amine

C14H25NS — CID 79411760

IUPACN-propyl-1-thiophen-3-ylheptan-3-amine
SMILESCCCCC(CCc1ccsc1)NCCC
InChIInChI=1S/C14H25NS/c1-3-5-6-14(15-10-4-2)8-7-13-9-11-16-12-13/h9,11-12,14-15H,3-8,10H2,1-2H3
InChIKeyRLNAAUPIWKNATG-UHFFFAOYSA-N
MW239.43 g/mol
LogP4.24
Rot. Bonds9

About N-propyl-1-thiophen-3-ylheptan-3-amine

N-propyl-1-thiophen-3-ylheptan-3-amine (PubChem CID 79411760) has the molecular formula C14H25NS and a molecular weight of 239.43 g/mol. Its IUPAC name is N-propyl-1-thiophen-3-ylheptan-3-amine.

Molecular Properties

Compound NameN-propyl-1-thiophen-3-ylheptan-3-amine
PubChem CID79411760
Molecular FormulaC14H25NS
Molecular Weight239.43 g/mol
Exact Mass239.17
IUPAC NameN-propyl-1-thiophen-3-ylheptan-3-amine
SMILESCCCCC(CCc1ccsc1)NCCC
InChIInChI=1S/C14H25NS/c1-3-5-6-14(15-10-4-2)8-7-13-9-11-16-12-13/h9,11-12,14-15H,3-8,10H2,1-2H3
InChIKeyRLNAAUPIWKNATG-UHFFFAOYSA-N
XLogP4.24
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.43
LogP ≤ 54.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-methylsulfonyl-N-propyl-4-thiophen-3-ylbutan-2-amine
CID 115623841
1-cyclopentyl-N-propyl-5-thiophen-3-ylpentan-3-amine
CID 115856935
N-(thiophen-3-ylmethyl)heptan-3-amine
CID 63946949
1-(oxan-2-yl)-N-propyl-5-thiophen-3-ylpentan-3-amine
CID 115857206
1-(2-bromophenyl)sulfanyl-N-propyl-4-thiophen-3-ylbutan-2-amine
CID 66145067
1-(3-chlorophenoxy)-N-propyl-4-thiophen-3-ylbutan-2-amine
CID 105147847
3,3-dimethyl-N-propyl-2-(2-thiophen-3-ylethyl)butan-1-amine
CID 83139408
N-ethyl-1-pyridin-4-yl-5-thiophen-3-ylpentan-3-amine
CID 105147906
1-cyclobutyl-N-propyl-3-thiophen-3-ylpropan-1-amine
CID 64986471
1-(2-methyl-1,3-thiazol-4-yl)-N-propyl-3-thiophen-3-ylpropan-1-amine
CID 105147754
N-propyl-3-thiophen-3-yl-1-(2,4,6-trimethylphenyl)propan-1-amine
CID 115857109
N-(2-thiophen-3-ylethyl)butan-1-amine
CID 60751767

Frequently Asked Questions

What is the IUPAC name of N-propyl-1-thiophen-3-ylheptan-3-amine?
The IUPAC name of N-propyl-1-thiophen-3-ylheptan-3-amine (CID 79411760) is N-propyl-1-thiophen-3-ylheptan-3-amine.
What is the SMILES notation for N-propyl-1-thiophen-3-ylheptan-3-amine?
The canonical SMILES for N-propyl-1-thiophen-3-ylheptan-3-amine is CCCCC(CCc1ccsc1)NCCC.
What is the InChIKey of N-propyl-1-thiophen-3-ylheptan-3-amine?
The InChIKey is RLNAAUPIWKNATG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NS/c1-3-5-6-14(15-10-4-2)8-7-13-9-11-16-12-13/h9,11-12,14-15H,3-8,10H2,1-2H3.
What are the key properties of N-propyl-1-thiophen-3-ylheptan-3-amine?
N-propyl-1-thiophen-3-ylheptan-3-amine has a molecular weight of 239.43 g/mol, XLogP of 4.24, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-1-thiophen-3-ylheptan-3-amine is sourced from PubChem (CID 79411760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).