2-(1-thiophen-3-ylpropan-2-ylamino)propan-1-ol

C10H17NOS — CID 115724718

IUPAC2-(1-thiophen-3-ylpropan-2-ylamino)propan-1-ol
SMILESCC(CO)NC(C)Cc1ccsc1
InChIInChI=1S/C10H17NOS/c1-8(11-9(2)6-12)5-10-3-4-13-7-10/h3-4,7-9,11-12H,5-6H2,1-2H3
InChIKeyYVZMLIOVVXKDKB-UHFFFAOYSA-N
MW199.32 g/mol
LogP1.65
Rot. Bonds5

About 2-(1-thiophen-3-ylpropan-2-ylamino)propan-1-ol

2-(1-thiophen-3-ylpropan-2-ylamino)propan-1-ol (PubChem CID 115724718) has the molecular formula C10H17NOS and a molecular weight of 199.32 g/mol. Its IUPAC name is 2-(1-thiophen-3-ylpropan-2-ylamino)propan-1-ol.

Molecular Properties

Compound Name2-(1-thiophen-3-ylpropan-2-ylamino)propan-1-ol
PubChem CID115724718
Molecular FormulaC10H17NOS
Molecular Weight199.32 g/mol
Exact Mass199.10
IUPAC Name2-(1-thiophen-3-ylpropan-2-ylamino)propan-1-ol
SMILESCC(CO)NC(C)Cc1ccsc1
InChIInChI=1S/C10H17NOS/c1-8(11-9(2)6-12)5-10-3-4-13-7-10/h3-4,7-9,11-12H,5-6H2,1-2H3
InChIKeyYVZMLIOVVXKDKB-UHFFFAOYSA-N
XLogP1.65
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.32
LogP ≤ 51.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1-thiophen-3-ylpropan-2-ylamino)propane-1,3-diol
CID 115724134
N-(1-thiophen-3-ylpropan-2-yl)heptan-2-amine
CID 61473529
1-thiophen-3-ylpropan-2-ylthiourea
CID 61473973
N-(1-thiophen-3-ylpropan-2-yl)hex-5-en-2-amine
CID 104581872
N-[1-(1-methylcyclopropyl)ethyl]-1-thiophen-3-ylpropan-2-amine
CID 61473217
6-(1-thiophen-3-ylpropan-2-ylamino)hexan-1-ol
CID 115906776
N-(1-pyridin-4-ylethyl)-1-thiophen-3-ylpropan-2-amine
CID 54952734
N-(1-thiophen-3-ylpropan-2-yl)formamide
CID 64992100
4-(4-methoxyphenyl)-N-(1-thiophen-3-ylpropan-2-yl)butan-2-amine
CID 61473299
2-[1-(4-bromophenyl)propan-2-ylamino]propan-1-ol
CID 103522264
2-(thiophen-3-ylmethyl)butan-1-ol
CID 21301482
5-methyl-2-[1-(1-thiophen-3-ylpropan-2-ylamino)ethyl]phenol
CID 61473528

Frequently Asked Questions

What is the IUPAC name of 2-(1-thiophen-3-ylpropan-2-ylamino)propan-1-ol?
The IUPAC name of 2-(1-thiophen-3-ylpropan-2-ylamino)propan-1-ol (CID 115724718) is 2-(1-thiophen-3-ylpropan-2-ylamino)propan-1-ol.
What is the SMILES notation for 2-(1-thiophen-3-ylpropan-2-ylamino)propan-1-ol?
The canonical SMILES for 2-(1-thiophen-3-ylpropan-2-ylamino)propan-1-ol is CC(CO)NC(C)Cc1ccsc1.
What is the InChIKey of 2-(1-thiophen-3-ylpropan-2-ylamino)propan-1-ol?
The InChIKey is YVZMLIOVVXKDKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NOS/c1-8(11-9(2)6-12)5-10-3-4-13-7-10/h3-4,7-9,11-12H,5-6H2,1-2H3.
What are the key properties of 2-(1-thiophen-3-ylpropan-2-ylamino)propan-1-ol?
2-(1-thiophen-3-ylpropan-2-ylamino)propan-1-ol has a molecular weight of 199.32 g/mol, XLogP of 1.65, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-thiophen-3-ylpropan-2-ylamino)propan-1-ol is sourced from PubChem (CID 115724718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).