N-methyl-2-(4-phenyl-5-propan-2-yl-1,3-thiazol-2-yl)propan-1-amine

C16H22N2S — CID 104513428

IUPACN-methyl-2-(4-phenyl-5-propan-2-yl-1,3-thiazol-2-yl)propan-1-amine
SMILESCNCC(C)c1nc(-c2ccccc2)c(C(C)C)s1
InChIInChI=1S/C16H22N2S/c1-11(2)15-14(13-8-6-5-7-9-13)18-16(19-15)12(3)10-17-4/h5-9,11-12,17H,10H2,1-4H3
InChIKeyLVPQHYTUCVNTAX-UHFFFAOYSA-N
MW274.43 g/mol
LogP4.26
Rot. Bonds5

About N-methyl-2-(4-phenyl-5-propan-2-yl-1,3-thiazol-2-yl)propan-1-amine

N-methyl-2-(4-phenyl-5-propan-2-yl-1,3-thiazol-2-yl)propan-1-amine (PubChem CID 104513428) has the molecular formula C16H22N2S and a molecular weight of 274.43 g/mol. Its IUPAC name is N-methyl-2-(4-phenyl-5-propan-2-yl-1,3-thiazol-2-yl)propan-1-amine.

Molecular Properties

Compound NameN-methyl-2-(4-phenyl-5-propan-2-yl-1,3-thiazol-2-yl)propan-1-amine
PubChem CID104513428
Molecular FormulaC16H22N2S
Molecular Weight274.43 g/mol
Exact Mass274.15
IUPAC NameN-methyl-2-(4-phenyl-5-propan-2-yl-1,3-thiazol-2-yl)propan-1-amine
SMILESCNCC(C)c1nc(-c2ccccc2)c(C(C)C)s1
InChIInChI=1S/C16H22N2S/c1-11(2)15-14(13-8-6-5-7-9-13)18-16(19-15)12(3)10-17-4/h5-9,11-12,17H,10H2,1-4H3
InChIKeyLVPQHYTUCVNTAX-UHFFFAOYSA-N
XLogP4.26
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.43
LogP ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-methylpropyl)-4-phenyl-5-propan-2-yl-1,3-thiazol-2-amine
CID 63470536
2-(4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)-N-methylpropan-1-amine
CID 113421285
2-(chloromethyl)-4-phenyl-5-propan-2-yl-1,3-thiazole
CID 62921644
2-methyl-N-[(4-phenyl-5-propan-2-yl-1,3-thiazol-2-yl)methyl]propan-2-amine
CID 62543216
2-tert-butyl-4-phenyl-5-propan-2-yl-1,3-thiazole;ethane
CID 170587640
N-methyl-2-(5-methyl-4-thiophen-2-yl-1,3-thiazol-2-yl)propan-1-amine
CID 104513339
5-ethyl-4-phenyl-2-propan-2-yl-1,3-thiazole
CID 90934410
N-[(4-phenyl-2-propan-2-yl-1,3-thiazol-5-yl)methyl]propan-2-amine
CID 81173870
(2S)-2-(cyclodecapentaenyl)-N-methylpropan-1-amine
CID 166722722
N-(4-phenyl-5-propan-2-yl-1,3-thiazol-2-yl)cyclopropanecarboxamide
CID 39001874
N-methyl-2-(5-phenyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)propan-1-amine
CID 106820673
4-phenyl-5-propan-2-yl-2-(pyrrolidin-2-ylmethyl)-1,3-thiazole
CID 62540204

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(4-phenyl-5-propan-2-yl-1,3-thiazol-2-yl)propan-1-amine?
The IUPAC name of N-methyl-2-(4-phenyl-5-propan-2-yl-1,3-thiazol-2-yl)propan-1-amine (CID 104513428) is N-methyl-2-(4-phenyl-5-propan-2-yl-1,3-thiazol-2-yl)propan-1-amine.
What is the SMILES notation for N-methyl-2-(4-phenyl-5-propan-2-yl-1,3-thiazol-2-yl)propan-1-amine?
The canonical SMILES for N-methyl-2-(4-phenyl-5-propan-2-yl-1,3-thiazol-2-yl)propan-1-amine is CNCC(C)c1nc(-c2ccccc2)c(C(C)C)s1.
What is the InChIKey of N-methyl-2-(4-phenyl-5-propan-2-yl-1,3-thiazol-2-yl)propan-1-amine?
The InChIKey is LVPQHYTUCVNTAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2S/c1-11(2)15-14(13-8-6-5-7-9-13)18-16(19-15)12(3)10-17-4/h5-9,11-12,17H,10H2,1-4H3.
What are the key properties of N-methyl-2-(4-phenyl-5-propan-2-yl-1,3-thiazol-2-yl)propan-1-amine?
N-methyl-2-(4-phenyl-5-propan-2-yl-1,3-thiazol-2-yl)propan-1-amine has a molecular weight of 274.43 g/mol, XLogP of 4.26, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(4-phenyl-5-propan-2-yl-1,3-thiazol-2-yl)propan-1-amine is sourced from PubChem (CID 104513428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).