4,5-dimethyl-N-(piperidin-2-ylmethyl)-N-propan-2-yl-1,3-thiazol-2-amine

C14H25N3S — CID 106641327

IUPAC4,5-dimethyl-N-(piperidin-2-ylmethyl)-N-propan-2-yl-1,3-thiazol-2-amine
SMILESCc1nc(N(CC2CCCCN2)C(C)C)sc1C
InChIInChI=1S/C14H25N3S/c1-10(2)17(9-13-7-5-6-8-15-13)14-16-11(3)12(4)18-14/h10,13,15H,5-9H2,1-4H3
InChIKeyKCBQTZJEDJXOMY-UHFFFAOYSA-N
MW267.44 g/mol
LogP3.12
Rot. Bonds4

About 4,5-dimethyl-N-(piperidin-2-ylmethyl)-N-propan-2-yl-1,3-thiazol-2-amine

4,5-dimethyl-N-(piperidin-2-ylmethyl)-N-propan-2-yl-1,3-thiazol-2-amine (PubChem CID 106641327) has the molecular formula C14H25N3S and a molecular weight of 267.44 g/mol. Its IUPAC name is 4,5-dimethyl-N-(piperidin-2-ylmethyl)-N-propan-2-yl-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4,5-dimethyl-N-(piperidin-2-ylmethyl)-N-propan-2-yl-1,3-thiazol-2-amine
PubChem CID106641327
Molecular FormulaC14H25N3S
Molecular Weight267.44 g/mol
Exact Mass267.18
IUPAC Name4,5-dimethyl-N-(piperidin-2-ylmethyl)-N-propan-2-yl-1,3-thiazol-2-amine
SMILESCc1nc(N(CC2CCCCN2)C(C)C)sc1C
InChIInChI=1S/C14H25N3S/c1-10(2)17(9-13-7-5-6-8-15-13)14-16-11(3)12(4)18-14/h10,13,15H,5-9H2,1-4H3
InChIKeyKCBQTZJEDJXOMY-UHFFFAOYSA-N
XLogP3.12
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.44
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-chloro-N-propan-2-yl-N-(pyrrolidin-2-ylmethyl)-1,3-thiazol-2-amine
CID 106619127
1,3-dimethyl-5-[piperidin-2-ylmethyl(propan-2-yl)amino]pyrazole-4-carbonitrile
CID 106641435
1-(2,5-dimethyl-1,3-thiazol-4-yl)-N-methyl-N-(piperidin-2-ylmethyl)ethanamine
CID 106622843
1-(2,4-dimethyl-1,3-thiazol-5-yl)-N-ethyl-N-(piperidin-2-ylmethyl)ethanamine
CID 106622746
4-ethoxy-6-methyl-N-(piperidin-2-ylmethyl)-N-propan-2-ylpyrimidin-2-amine
CID 106641392
2-methyl-4-nitro-N-(piperidin-2-ylmethyl)-N-propan-2-ylaniline
CID 106641300
N-(piperidin-2-ylmethyl)-N-propan-2-yl-1,3-benzoxazol-2-amine
CID 106641412
N-[1-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]-N-(pyrrolidin-2-ylmethyl)propan-2-amine
CID 106603240
1-(2,4-dimethyl-1,3-thiazol-5-yl)-N-(piperidin-2-ylmethyl)ethanamine
CID 54963110
N-(piperidin-2-ylmethyl)-N-propan-2-ylpyrido[2,3-b]pyrazin-6-amine
CID 106641355
2-[piperidin-2-ylmethyl(propan-2-yl)amino]pyrimidine-4-carbonitrile
CID 107552788
N-[(1,3-dimethylpyrazol-4-yl)methyl]-N-(piperidin-2-ylmethyl)propan-2-amine
CID 106622204

Frequently Asked Questions

What is the IUPAC name of 4,5-dimethyl-N-(piperidin-2-ylmethyl)-N-propan-2-yl-1,3-thiazol-2-amine?
The IUPAC name of 4,5-dimethyl-N-(piperidin-2-ylmethyl)-N-propan-2-yl-1,3-thiazol-2-amine (CID 106641327) is 4,5-dimethyl-N-(piperidin-2-ylmethyl)-N-propan-2-yl-1,3-thiazol-2-amine.
What is the SMILES notation for 4,5-dimethyl-N-(piperidin-2-ylmethyl)-N-propan-2-yl-1,3-thiazol-2-amine?
The canonical SMILES for 4,5-dimethyl-N-(piperidin-2-ylmethyl)-N-propan-2-yl-1,3-thiazol-2-amine is Cc1nc(N(CC2CCCCN2)C(C)C)sc1C.
What is the InChIKey of 4,5-dimethyl-N-(piperidin-2-ylmethyl)-N-propan-2-yl-1,3-thiazol-2-amine?
The InChIKey is KCBQTZJEDJXOMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3S/c1-10(2)17(9-13-7-5-6-8-15-13)14-16-11(3)12(4)18-14/h10,13,15H,5-9H2,1-4H3.
What are the key properties of 4,5-dimethyl-N-(piperidin-2-ylmethyl)-N-propan-2-yl-1,3-thiazol-2-amine?
4,5-dimethyl-N-(piperidin-2-ylmethyl)-N-propan-2-yl-1,3-thiazol-2-amine has a molecular weight of 267.44 g/mol, XLogP of 3.12, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-dimethyl-N-(piperidin-2-ylmethyl)-N-propan-2-yl-1,3-thiazol-2-amine is sourced from PubChem (CID 106641327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).