N',N'-dipropyl-2-thiophen-2-ylpropane-1,3-diamine

C13H24N2S — CID 82107436

IUPACN',N'-dipropyl-2-thiophen-2-ylpropane-1,3-diamine
SMILESCCCN(CCC)CC(CN)c1cccs1
InChIInChI=1S/C13H24N2S/c1-3-7-15(8-4-2)11-12(10-14)13-6-5-9-16-13/h5-6,9,12H,3-4,7-8,10-11,14H2,1-2H3
InChIKeyCAMYNHFPXAMVIL-UHFFFAOYSA-N
MW240.42 g/mol
LogP2.91
Rot. Bonds8

About N',N'-dipropyl-2-thiophen-2-ylpropane-1,3-diamine

N',N'-dipropyl-2-thiophen-2-ylpropane-1,3-diamine (PubChem CID 82107436) has the molecular formula C13H24N2S and a molecular weight of 240.42 g/mol. Its IUPAC name is N',N'-dipropyl-2-thiophen-2-ylpropane-1,3-diamine.

Molecular Properties

Compound NameN',N'-dipropyl-2-thiophen-2-ylpropane-1,3-diamine
PubChem CID82107436
Molecular FormulaC13H24N2S
Molecular Weight240.42 g/mol
Exact Mass240.17
IUPAC NameN',N'-dipropyl-2-thiophen-2-ylpropane-1,3-diamine
SMILESCCCN(CCC)CC(CN)c1cccs1
InChIInChI=1S/C13H24N2S/c1-3-7-15(8-4-2)11-12(10-14)13-6-5-9-16-13/h5-6,9,12H,3-4,7-8,10-11,14H2,1-2H3
InChIKeyCAMYNHFPXAMVIL-UHFFFAOYSA-N
XLogP2.91
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.42
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-thiophen-2-ylpentan-1-amine
CID 54559295
N-butyl-N-(2-chloro-2-thiophen-2-ylethyl)butan-1-amine
CID 82215055
2-(4-methoxyphenyl)-N',N'-dipropylpropane-1,3-diamine
CID 82107529
(3S)-4-amino-3-thiophen-2-ylbutanal
CID 143655944
N,N-dimethyl-1-thiophen-2-ylethane-1,2-diamine
CID 3842630
(2S)-2-methoxy-2-thiophen-2-ylethanamine
CID 26722465
2-[methyl(propyl)amino]-2-thiophen-2-ylacetonitrile
CID 82075985
2-(2,2-dimethylhydrazinyl)-2-thiophen-2-ylethanamine
CID 83011900
(2R)-3-cyclopropyl-2-thiophen-2-ylpropan-1-amine
CID 124676129
N-(3-amino-2-thiophen-2-ylpropyl)acetamide
CID 46186346
2-tetradecan-7-ylthiophene
CID 137450901
3-nitro-2-thiophen-2-ylpropan-1-amine
CID 10726209

Frequently Asked Questions

What is the IUPAC name of N',N'-dipropyl-2-thiophen-2-ylpropane-1,3-diamine?
The IUPAC name of N',N'-dipropyl-2-thiophen-2-ylpropane-1,3-diamine (CID 82107436) is N',N'-dipropyl-2-thiophen-2-ylpropane-1,3-diamine.
What is the SMILES notation for N',N'-dipropyl-2-thiophen-2-ylpropane-1,3-diamine?
The canonical SMILES for N',N'-dipropyl-2-thiophen-2-ylpropane-1,3-diamine is CCCN(CCC)CC(CN)c1cccs1.
What is the InChIKey of N',N'-dipropyl-2-thiophen-2-ylpropane-1,3-diamine?
The InChIKey is CAMYNHFPXAMVIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2S/c1-3-7-15(8-4-2)11-12(10-14)13-6-5-9-16-13/h5-6,9,12H,3-4,7-8,10-11,14H2,1-2H3.
What are the key properties of N',N'-dipropyl-2-thiophen-2-ylpropane-1,3-diamine?
N',N'-dipropyl-2-thiophen-2-ylpropane-1,3-diamine has a molecular weight of 240.42 g/mol, XLogP of 2.91, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N',N'-dipropyl-2-thiophen-2-ylpropane-1,3-diamine is sourced from PubChem (CID 82107436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).