2-methyl-N-[[2-(6-methyl-2-pyridinyl)-4-propan-2-yl-1,3-thiazol-5-yl]methyl]propan-2-amine

C17H25N3S — CID 114365821

IUPAC2-methyl-N-[[2-(6-methyl-2-pyridinyl)-4-propan-2-yl-1,3-thiazol-5-yl]methyl]propan-2-amine
SMILESCc1cccc(-c2nc(C(C)C)c(CNC(C)(C)C)s2)n1
InChIInChI=1S/C17H25N3S/c1-11(2)15-14(10-18-17(4,5)6)21-16(20-15)13-9-7-8-12(3)19-13/h7-9,11,18H,10H2,1-6H3
InChIKeyWRYAOHLQJZKIDM-UHFFFAOYSA-N
MW303.48 g/mol
LogP4.53
Rot. Bonds4

About 2-methyl-N-[[2-(6-methyl-2-pyridinyl)-4-propan-2-yl-1,3-thiazol-5-yl]methyl]propan-2-amine

2-methyl-N-[[2-(6-methyl-2-pyridinyl)-4-propan-2-yl-1,3-thiazol-5-yl]methyl]propan-2-amine (PubChem CID 114365821) has the molecular formula C17H25N3S and a molecular weight of 303.48 g/mol. Its IUPAC name is 2-methyl-N-[[2-(6-methyl-2-pyridinyl)-4-propan-2-yl-1,3-thiazol-5-yl]methyl]propan-2-amine.

Molecular Properties

Compound Name2-methyl-N-[[2-(6-methyl-2-pyridinyl)-4-propan-2-yl-1,3-thiazol-5-yl]methyl]propan-2-amine
PubChem CID114365821
Molecular FormulaC17H25N3S
Molecular Weight303.48 g/mol
Exact Mass303.18
IUPAC Name2-methyl-N-[[2-(6-methyl-2-pyridinyl)-4-propan-2-yl-1,3-thiazol-5-yl]methyl]propan-2-amine
SMILESCc1cccc(-c2nc(C(C)C)c(CNC(C)(C)C)s2)n1
InChIInChI=1S/C17H25N3S/c1-11(2)15-14(10-18-17(4,5)6)21-16(20-15)13-9-7-8-12(3)19-13/h7-9,11,18H,10H2,1-6H3
InChIKeyWRYAOHLQJZKIDM-UHFFFAOYSA-N
XLogP4.53
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.48
LogP ≤ 54.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-methyl-N-[[2-(6-methyl-2-pyridinyl)-4-propan-2-yl-1,3-thiazol-5-yl]methyl]propan-2-amine with MolForge

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Related Compounds

N-methyl-1-[2-(2-methylpyrimidin-4-yl)-4-propan-2-yl-1,3-thiazol-5-yl]methanamine
CID 114364758
N-[[4-methyl-2-(6-methyl-2-pyridinyl)-1,3-thiazol-5-yl]methyl]ethanamine
CID 63553848
1-[2-(5-chloro-2-pyridinyl)-4-propan-2-yl-1,3-thiazol-5-yl]-N-methylmethanamine
CID 114364911
N-ethyl-1-[4-methyl-2-(6-methyl-2-pyridinyl)-1,3-thiazol-5-yl]ethanamine
CID 55222339
N-[[4-methyl-2-(6-methyl-2-pyridinyl)-1,3-thiazol-5-yl]methyl]cyclopropanamine
CID 63554033
N-[[4-(methoxymethyl)-2-pyridin-2-yl-1,3-thiazol-5-yl]methyl]-2-methylpropan-2-amine
CID 114366796
5-[(tert-butylamino)methyl]-N-methyl-N-(2-methylbutyl)-4-propan-2-yl-1,3-thiazol-2-amine
CID 79381144
N-[[2-(2-ethoxyethyl)-4-propan-2-yl-1,3-thiazol-5-yl]methyl]-2-methylpropan-2-amine
CID 106815449
2-methyl-N-[[4-(2-methylpropyl)-2-pyridin-3-yl-1,3-thiazol-5-yl]methyl]propan-2-amine
CID 114369758
N-[[4-ethyl-2-(furan-2-yl)-1,3-thiazol-5-yl]methyl]-2-methylpropan-2-amine
CID 113459709
2-methyl-N-[[4-(2-methylpropyl)-2-pyrimidin-2-yl-1,3-thiazol-5-yl]methyl]propan-2-amine
CID 114369705
N-[(4-propan-2-yl-2-pyrimidin-2-yl-1,3-thiazol-5-yl)methyl]propan-2-amine
CID 114365434

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[[2-(6-methyl-2-pyridinyl)-4-propan-2-yl-1,3-thiazol-5-yl]methyl]propan-2-amine?
The IUPAC name of 2-methyl-N-[[2-(6-methyl-2-pyridinyl)-4-propan-2-yl-1,3-thiazol-5-yl]methyl]propan-2-amine (CID 114365821) is 2-methyl-N-[[2-(6-methyl-2-pyridinyl)-4-propan-2-yl-1,3-thiazol-5-yl]methyl]propan-2-amine.
What is the SMILES notation for 2-methyl-N-[[2-(6-methyl-2-pyridinyl)-4-propan-2-yl-1,3-thiazol-5-yl]methyl]propan-2-amine?
The canonical SMILES for 2-methyl-N-[[2-(6-methyl-2-pyridinyl)-4-propan-2-yl-1,3-thiazol-5-yl]methyl]propan-2-amine is Cc1cccc(-c2nc(C(C)C)c(CNC(C)(C)C)s2)n1.
What is the InChIKey of 2-methyl-N-[[2-(6-methyl-2-pyridinyl)-4-propan-2-yl-1,3-thiazol-5-yl]methyl]propan-2-amine?
The InChIKey is WRYAOHLQJZKIDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3S/c1-11(2)15-14(10-18-17(4,5)6)21-16(20-15)13-9-7-8-12(3)19-13/h7-9,11,18H,10H2,1-6H3.
What are the key properties of 2-methyl-N-[[2-(6-methyl-2-pyridinyl)-4-propan-2-yl-1,3-thiazol-5-yl]methyl]propan-2-amine?
2-methyl-N-[[2-(6-methyl-2-pyridinyl)-4-propan-2-yl-1,3-thiazol-5-yl]methyl]propan-2-amine has a molecular weight of 303.48 g/mol, XLogP of 4.53, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[[2-(6-methyl-2-pyridinyl)-4-propan-2-yl-1,3-thiazol-5-yl]methyl]propan-2-amine is sourced from PubChem (CID 114365821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).