N-cyclopropyl-4-[4-(dimethylamino)phenyl]-1,3-thiazol-2-amine

C14H17N3S — CID 62956991

IUPACN-cyclopropyl-4-[4-(dimethylamino)phenyl]-1,3-thiazol-2-amine
SMILESCN(C)c1ccc(-c2csc(NC3CC3)n2)cc1
InChIInChI=1S/C14H17N3S/c1-17(2)12-7-3-10(4-8-12)13-9-18-14(16-13)15-11-5-6-11/h3-4,7-9,11H,5-6H2,1-2H3,(H,15,16)
InChIKeyXIZOVUXLXSHRNZ-UHFFFAOYSA-N
MW259.38 g/mol
LogP3.45
Rot. Bonds4

About N-cyclopropyl-4-[4-(dimethylamino)phenyl]-1,3-thiazol-2-amine

N-cyclopropyl-4-[4-(dimethylamino)phenyl]-1,3-thiazol-2-amine (PubChem CID 62956991) has the molecular formula C14H17N3S and a molecular weight of 259.38 g/mol. Its IUPAC name is N-cyclopropyl-4-[4-(dimethylamino)phenyl]-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-cyclopropyl-4-[4-(dimethylamino)phenyl]-1,3-thiazol-2-amine
PubChem CID62956991
Molecular FormulaC14H17N3S
Molecular Weight259.38 g/mol
Exact Mass259.11
IUPAC NameN-cyclopropyl-4-[4-(dimethylamino)phenyl]-1,3-thiazol-2-amine
SMILESCN(C)c1ccc(-c2csc(NC3CC3)n2)cc1
InChIInChI=1S/C14H17N3S/c1-17(2)12-7-3-10(4-8-12)13-9-18-14(16-13)15-11-5-6-11/h3-4,7-9,11H,5-6H2,1-2H3,(H,15,16)
InChIKeyXIZOVUXLXSHRNZ-UHFFFAOYSA-N
XLogP3.45
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.38
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopropyl-4-(3-methylphenyl)-1,3-thiazol-2-amine
CID 62941085
4-[4-(dimethylamino)phenyl]-1,3-thiazol-2-amine
CID 18526481
4-(3-chloro-4-methoxyphenyl)-N-cyclopropyl-1,3-thiazol-2-amine
CID 8750909
4-(1,3-benzodioxol-5-yl)-N-cyclopentyl-1,3-thiazol-2-amine
CID 8961741
N-(6-chloro-3-pyridinyl)-4-[4-(dimethylamino)phenyl]-1,3-thiazol-2-amine
CID 166340336
(3R)-5-[2-(cyclopropylamino)-1,3-thiazol-4-yl]-3-methyl-1,3-dihydroindol-2-one
CID 9421585
N-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-4-(dimethylamino)benzamide
CID 3584332
N,N-dimethyl-4-(2-piperidin-2-yl-1,3-thiazol-4-yl)aniline
CID 67356783
N-cyclopropyl-4-(2,5-dimethyl-1,3-thiazol-4-yl)-1,3-thiazol-2-amine
CID 63751719
N-[[4-(dimethylamino)phenyl]methylideneamino]-4-(4-methoxyphenyl)-1,3-thiazol-2-amine
CID 5230090
N-[bis[4-(dimethylamino)phenyl]methylideneamino]-4-(4-methoxyphenyl)-1,3-thiazol-2-amine
CID 4086590
4-[2-[(2E)-2-[[4-(dimethylamino)phenyl]methylidene]hydrazinyl]-1,3-thiazol-4-yl]phenol;hydrobromide
CID 172885903

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-4-[4-(dimethylamino)phenyl]-1,3-thiazol-2-amine?
The IUPAC name of N-cyclopropyl-4-[4-(dimethylamino)phenyl]-1,3-thiazol-2-amine (CID 62956991) is N-cyclopropyl-4-[4-(dimethylamino)phenyl]-1,3-thiazol-2-amine.
What is the SMILES notation for N-cyclopropyl-4-[4-(dimethylamino)phenyl]-1,3-thiazol-2-amine?
The canonical SMILES for N-cyclopropyl-4-[4-(dimethylamino)phenyl]-1,3-thiazol-2-amine is CN(C)c1ccc(-c2csc(NC3CC3)n2)cc1.
What is the InChIKey of N-cyclopropyl-4-[4-(dimethylamino)phenyl]-1,3-thiazol-2-amine?
The InChIKey is XIZOVUXLXSHRNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3S/c1-17(2)12-7-3-10(4-8-12)13-9-18-14(16-13)15-11-5-6-11/h3-4,7-9,11H,5-6H2,1-2H3,(H,15,16).
What are the key properties of N-cyclopropyl-4-[4-(dimethylamino)phenyl]-1,3-thiazol-2-amine?
N-cyclopropyl-4-[4-(dimethylamino)phenyl]-1,3-thiazol-2-amine has a molecular weight of 259.38 g/mol, XLogP of 3.45, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-4-[4-(dimethylamino)phenyl]-1,3-thiazol-2-amine is sourced from PubChem (CID 62956991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).