1,2-dimethyl-N-[(5-methyl-1,3-thiazol-2-yl)methyl]piperidin-4-amine

C12H21N3S — CID 103786250

IUPAC1,2-dimethyl-N-[(5-methyl-1,3-thiazol-2-yl)methyl]piperidin-4-amine
SMILESCc1cnc(CNC2CCN(C)C(C)C2)s1
InChIInChI=1S/C12H21N3S/c1-9-6-11(4-5-15(9)3)13-8-12-14-7-10(2)16-12/h7,9,11,13H,4-6,8H2,1-3H3
InChIKeyGCJZFCXADNMLHH-UHFFFAOYSA-N
MW239.39 g/mol
LogP2.02
Rot. Bonds3

About 1,2-dimethyl-N-[(5-methyl-1,3-thiazol-2-yl)methyl]piperidin-4-amine

1,2-dimethyl-N-[(5-methyl-1,3-thiazol-2-yl)methyl]piperidin-4-amine (PubChem CID 103786250) has the molecular formula C12H21N3S and a molecular weight of 239.39 g/mol. Its IUPAC name is 1,2-dimethyl-N-[(5-methyl-1,3-thiazol-2-yl)methyl]piperidin-4-amine.

Molecular Properties

Compound Name1,2-dimethyl-N-[(5-methyl-1,3-thiazol-2-yl)methyl]piperidin-4-amine
PubChem CID103786250
Molecular FormulaC12H21N3S
Molecular Weight239.39 g/mol
Exact Mass239.15
IUPAC Name1,2-dimethyl-N-[(5-methyl-1,3-thiazol-2-yl)methyl]piperidin-4-amine
SMILESCc1cnc(CNC2CCN(C)C(C)C2)s1
InChIInChI=1S/C12H21N3S/c1-9-6-11(4-5-15(9)3)13-8-12-14-7-10(2)16-12/h7,9,11,13H,4-6,8H2,1-3H3
InChIKeyGCJZFCXADNMLHH-UHFFFAOYSA-N
XLogP2.02
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.39
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-methyl-N-[(5-methyl-1,3-thiazol-2-yl)methyl]azepan-4-amine
CID 103859828
1,2,5-trimethyl-N-[(5-methyl-1,3-thiazol-2-yl)methyl]piperidin-4-amine
CID 103786303
1-ethyl-N-[(5-methyl-1,3-thiazol-2-yl)methyl]piperidin-4-amine
CID 115724500
N-[(5-methyl-1,3-thiazol-2-yl)methyl]cyclopropanamine;dihydrochloride
CID 56773659
N-[(2,5-dimethylthiophen-3-yl)methyl]-1,2-dimethylpiperidin-4-amine
CID 80711280
N-[(5-ethyl-1,3-thiazol-2-yl)methyl]-1,5-dimethylpyrrolidin-3-amine
CID 115724910
N-[(5-methyl-1,3-thiazol-2-yl)methyl]cycloheptanamine
CID 115655830
N-ethyl-2-methyl-1-[(5-methyl-1,3-thiazol-2-yl)methyl]piperidin-4-amine
CID 114127659
1-(2-methylpropyl)-N-[(5-methyl-1,3-thiazol-2-yl)methyl]piperidin-4-amine
CID 113262193
N-[(5-methyl-1,3-thiazol-2-yl)methyl]oxetan-3-amine
CID 103874822
1,2-dimethyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]piperidin-4-amine
CID 79032377
1,2-dimethyl-N-[(2-methylphenyl)methyl]piperidin-4-amine
CID 79032126

Frequently Asked Questions

What is the IUPAC name of 1,2-dimethyl-N-[(5-methyl-1,3-thiazol-2-yl)methyl]piperidin-4-amine?
The IUPAC name of 1,2-dimethyl-N-[(5-methyl-1,3-thiazol-2-yl)methyl]piperidin-4-amine (CID 103786250) is 1,2-dimethyl-N-[(5-methyl-1,3-thiazol-2-yl)methyl]piperidin-4-amine.
What is the SMILES notation for 1,2-dimethyl-N-[(5-methyl-1,3-thiazol-2-yl)methyl]piperidin-4-amine?
The canonical SMILES for 1,2-dimethyl-N-[(5-methyl-1,3-thiazol-2-yl)methyl]piperidin-4-amine is Cc1cnc(CNC2CCN(C)C(C)C2)s1.
What is the InChIKey of 1,2-dimethyl-N-[(5-methyl-1,3-thiazol-2-yl)methyl]piperidin-4-amine?
The InChIKey is GCJZFCXADNMLHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3S/c1-9-6-11(4-5-15(9)3)13-8-12-14-7-10(2)16-12/h7,9,11,13H,4-6,8H2,1-3H3.
What are the key properties of 1,2-dimethyl-N-[(5-methyl-1,3-thiazol-2-yl)methyl]piperidin-4-amine?
1,2-dimethyl-N-[(5-methyl-1,3-thiazol-2-yl)methyl]piperidin-4-amine has a molecular weight of 239.39 g/mol, XLogP of 2.02, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dimethyl-N-[(5-methyl-1,3-thiazol-2-yl)methyl]piperidin-4-amine is sourced from PubChem (CID 103786250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).