2-methyl-N-[[2-methyl-3-(1,3-thiazol-4-ylmethyl)oxolan-3-yl]methyl]propan-2-amine

C14H24N2OS — CID 114535055

IUPAC2-methyl-N-[[2-methyl-3-(1,3-thiazol-4-ylmethyl)oxolan-3-yl]methyl]propan-2-amine
SMILESCC1OCCC1(CNC(C)(C)C)Cc1cscn1
InChIInChI=1S/C14H24N2OS/c1-11-14(5-6-17-11,9-16-13(2,3)4)7-12-8-18-10-15-12/h8,10-11,16H,5-7,9H2,1-4H3
InChIKeyIIJUUQNGKZXGKY-UHFFFAOYSA-N
MW268.43 g/mol
LogP2.87
Rot. Bonds4

About 2-methyl-N-[[2-methyl-3-(1,3-thiazol-4-ylmethyl)oxolan-3-yl]methyl]propan-2-amine

2-methyl-N-[[2-methyl-3-(1,3-thiazol-4-ylmethyl)oxolan-3-yl]methyl]propan-2-amine (PubChem CID 114535055) has the molecular formula C14H24N2OS and a molecular weight of 268.43 g/mol. Its IUPAC name is 2-methyl-N-[[2-methyl-3-(1,3-thiazol-4-ylmethyl)oxolan-3-yl]methyl]propan-2-amine.

Molecular Properties

Compound Name2-methyl-N-[[2-methyl-3-(1,3-thiazol-4-ylmethyl)oxolan-3-yl]methyl]propan-2-amine
PubChem CID114535055
Molecular FormulaC14H24N2OS
Molecular Weight268.43 g/mol
Exact Mass268.16
IUPAC Name2-methyl-N-[[2-methyl-3-(1,3-thiazol-4-ylmethyl)oxolan-3-yl]methyl]propan-2-amine
SMILESCC1OCCC1(CNC(C)(C)C)Cc1cscn1
InChIInChI=1S/C14H24N2OS/c1-11-14(5-6-17-11,9-16-13(2,3)4)7-12-8-18-10-15-12/h8,10-11,16H,5-7,9H2,1-4H3
InChIKeyIIJUUQNGKZXGKY-UHFFFAOYSA-N
XLogP2.87
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.43
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-methyl-N-[[2-methyl-3-(1,3-thiazol-4-ylmethyl)oxolan-3-yl]methyl]propan-2-amine with MolForge

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Related Compounds

2-ethyl-N-(2-methoxyethyl)-2-(1,3-thiazol-4-ylmethyl)butan-1-amine
CID 55107041
N-[[4-(1,3-thiazol-4-ylmethyl)oxan-4-yl]methyl]propan-2-amine
CID 55130252
2-methoxy-N-[[4-(1,3-thiazol-4-ylmethyl)oxan-4-yl]methyl]ethanamine
CID 55131989
N-[[3-(1,3-thiazol-4-ylmethyl)oxan-3-yl]methyl]propan-1-amine
CID 55150130
N-[[3-(1,3-thiazol-4-ylmethyl)oxolan-3-yl]methyl]ethanamine
CID 62717709
2-methyl-N-[[3-(1,3-thiazol-4-ylmethyl)oxolan-3-yl]methyl]propan-2-amine
CID 62717727
N-(2-methoxyethyl)-2-methyl-2-(1,3-thiazol-4-ylmethyl)butan-1-amine
CID 62718311
N-methyl-1-[3-(1,3-thiazol-4-ylmethyl)oxolan-3-yl]methanamine
CID 62718502
N-[[3-(1,3-thiazol-4-ylmethyl)oxolan-3-yl]methyl]cyclopropanamine
CID 62718525
2-methoxy-N-[[3-(1,3-thiazol-4-ylmethyl)oxolan-3-yl]methyl]ethanamine
CID 62718538
N-[[3-(1,3-thiazol-4-ylmethyl)oxolan-3-yl]methyl]propan-2-amine
CID 62719206
2-methyl-N-[[3-(1,3-thiazol-4-ylmethyl)oxolan-3-yl]methyl]propan-1-amine
CID 62719397

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[[2-methyl-3-(1,3-thiazol-4-ylmethyl)oxolan-3-yl]methyl]propan-2-amine?
The IUPAC name of 2-methyl-N-[[2-methyl-3-(1,3-thiazol-4-ylmethyl)oxolan-3-yl]methyl]propan-2-amine (CID 114535055) is 2-methyl-N-[[2-methyl-3-(1,3-thiazol-4-ylmethyl)oxolan-3-yl]methyl]propan-2-amine.
What is the SMILES notation for 2-methyl-N-[[2-methyl-3-(1,3-thiazol-4-ylmethyl)oxolan-3-yl]methyl]propan-2-amine?
The canonical SMILES for 2-methyl-N-[[2-methyl-3-(1,3-thiazol-4-ylmethyl)oxolan-3-yl]methyl]propan-2-amine is CC1OCCC1(CNC(C)(C)C)Cc1cscn1.
What is the InChIKey of 2-methyl-N-[[2-methyl-3-(1,3-thiazol-4-ylmethyl)oxolan-3-yl]methyl]propan-2-amine?
The InChIKey is IIJUUQNGKZXGKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2OS/c1-11-14(5-6-17-11,9-16-13(2,3)4)7-12-8-18-10-15-12/h8,10-11,16H,5-7,9H2,1-4H3.
What are the key properties of 2-methyl-N-[[2-methyl-3-(1,3-thiazol-4-ylmethyl)oxolan-3-yl]methyl]propan-2-amine?
2-methyl-N-[[2-methyl-3-(1,3-thiazol-4-ylmethyl)oxolan-3-yl]methyl]propan-2-amine has a molecular weight of 268.43 g/mol, XLogP of 2.87, 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-methyl-3-(1,3-thiazol-4-ylmethyl)oxolan-3-yl]methyl]propan-2-amine is sourced from PubChem (CID 114535055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).