2-cyclopropyl-2-[(2-thiophen-2-yl-1,3-thiazol-5-yl)methylamino]propan-1-ol

C14H18N2OS2 — CID 111977204

IUPAC2-cyclopropyl-2-[(2-thiophen-2-yl-1,3-thiazol-5-yl)methylamino]propan-1-ol
SMILESCC(CO)(NCc1cnc(-c2cccs2)s1)C1CC1
InChIInChI=1S/C14H18N2OS2/c1-14(9-17,10-4-5-10)16-8-11-7-15-13(19-11)12-3-2-6-18-12/h2-3,6-7,10,16-17H,4-5,8-9H2,1H3
InChIKeyFTUQURRQHNCTID-UHFFFAOYSA-N
MW294.44 g/mol
LogP3.12
Rot. Bonds6

About 2-cyclopropyl-2-[(2-thiophen-2-yl-1,3-thiazol-5-yl)methylamino]propan-1-ol

2-cyclopropyl-2-[(2-thiophen-2-yl-1,3-thiazol-5-yl)methylamino]propan-1-ol (PubChem CID 111977204) has the molecular formula C14H18N2OS2 and a molecular weight of 294.44 g/mol. Its IUPAC name is 2-cyclopropyl-2-[(2-thiophen-2-yl-1,3-thiazol-5-yl)methylamino]propan-1-ol.

Molecular Properties

Compound Name2-cyclopropyl-2-[(2-thiophen-2-yl-1,3-thiazol-5-yl)methylamino]propan-1-ol
PubChem CID111977204
Molecular FormulaC14H18N2OS2
Molecular Weight294.44 g/mol
Exact Mass294.09
IUPAC Name2-cyclopropyl-2-[(2-thiophen-2-yl-1,3-thiazol-5-yl)methylamino]propan-1-ol
SMILESCC(CO)(NCc1cnc(-c2cccs2)s1)C1CC1
InChIInChI=1S/C14H18N2OS2/c1-14(9-17,10-4-5-10)16-8-11-7-15-13(19-11)12-3-2-6-18-12/h2-3,6-7,10,16-17H,4-5,8-9H2,1H3
InChIKeyFTUQURRQHNCTID-UHFFFAOYSA-N
XLogP3.12
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.44
LogP ≤ 53.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-cyclopropyl-2-[(2-thiophen-2-yl-1,3-thiazol-5-yl)methylamino]propan-1-ol with MolForge

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Related Compounds

[1-[[(2-thiophen-2-yl-1,3-thiazol-5-yl)methylamino]methyl]cyclopropyl]methanol
CID 111916796
3-[(2-thiophen-2-yl-1,3-thiazol-5-yl)methylamino]pentan-1-ol
CID 111916731
4-[(2-thiophen-2-yl-1,3-thiazol-5-yl)methylamino]piperidine-1-carboxamide
CID 71975057
[3-[(2-thiophen-2-yl-1,3-thiazol-5-yl)methylamino]phenyl]methanol
CID 99791904
2-(furan-2-yl)-2-[(2-thiophen-2-yl-1,3-thiazol-5-yl)methylamino]ethanol
CID 111916789
2-[(4-bromothiophen-2-yl)methylamino]-2-cyclopropylpropan-1-ol
CID 115685147
5-[[(2-cyclopropyl-1-hydroxypropan-2-yl)amino]methyl]thiophene-2-carbonitrile
CID 115685158
4-methyl-3-[(2-thiophen-2-yl-1,3-thiazol-5-yl)methylamino]benzamide
CID 71913528
1-[(2-thiophen-2-yl-1,3-thiazol-5-yl)methyl]pyrrolidine-2-carboxylic acid
CID 122036431
2-(2-thiophen-2-yl-1,3-thiazol-5-yl)propan-1-ol
CID 115091257
N-(1-amino-2-cyclopropylpropan-2-yl)-2-thiophen-2-yl-1,3-thiazole-4-carboxamide;dihydrochloride
CID 119575796
5-[[(2-cyclopropyl-1-hydroxypropan-2-yl)amino]methyl]furan-2-carbonitrile
CID 115685161

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-2-[(2-thiophen-2-yl-1,3-thiazol-5-yl)methylamino]propan-1-ol?
The IUPAC name of 2-cyclopropyl-2-[(2-thiophen-2-yl-1,3-thiazol-5-yl)methylamino]propan-1-ol (CID 111977204) is 2-cyclopropyl-2-[(2-thiophen-2-yl-1,3-thiazol-5-yl)methylamino]propan-1-ol.
What is the SMILES notation for 2-cyclopropyl-2-[(2-thiophen-2-yl-1,3-thiazol-5-yl)methylamino]propan-1-ol?
The canonical SMILES for 2-cyclopropyl-2-[(2-thiophen-2-yl-1,3-thiazol-5-yl)methylamino]propan-1-ol is CC(CO)(NCc1cnc(-c2cccs2)s1)C1CC1.
What is the InChIKey of 2-cyclopropyl-2-[(2-thiophen-2-yl-1,3-thiazol-5-yl)methylamino]propan-1-ol?
The InChIKey is FTUQURRQHNCTID-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2OS2/c1-14(9-17,10-4-5-10)16-8-11-7-15-13(19-11)12-3-2-6-18-12/h2-3,6-7,10,16-17H,4-5,8-9H2,1H3.
What are the key properties of 2-cyclopropyl-2-[(2-thiophen-2-yl-1,3-thiazol-5-yl)methylamino]propan-1-ol?
2-cyclopropyl-2-[(2-thiophen-2-yl-1,3-thiazol-5-yl)methylamino]propan-1-ol has a molecular weight of 294.44 g/mol, XLogP of 3.12, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-2-[(2-thiophen-2-yl-1,3-thiazol-5-yl)methylamino]propan-1-ol is sourced from PubChem (CID 111977204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).