[1-[5-methyl-4-(1-methylpiperidin-3-yl)-1,3-thiazol-2-yl]cyclopropyl]methanamine

C14H23N3S — CID 116865386

IUPAC[1-[5-methyl-4-(1-methylpiperidin-3-yl)-1,3-thiazol-2-yl]cyclopropyl]methanamine
SMILESCc1sc(C2(CN)CC2)nc1C1CCCN(C)C1
InChIInChI=1S/C14H23N3S/c1-10-12(11-4-3-7-17(2)8-11)16-13(18-10)14(9-15)5-6-14/h11H,3-9,15H2,1-2H3
InChIKeyDQHOGWNCGHMKPV-UHFFFAOYSA-N
MW265.43 g/mol
LogP2.25
Rot. Bonds3

About [1-[5-methyl-4-(1-methylpiperidin-3-yl)-1,3-thiazol-2-yl]cyclopropyl]methanamine

[1-[5-methyl-4-(1-methylpiperidin-3-yl)-1,3-thiazol-2-yl]cyclopropyl]methanamine (PubChem CID 116865386) has the molecular formula C14H23N3S and a molecular weight of 265.43 g/mol. Its IUPAC name is [1-[5-methyl-4-(1-methylpiperidin-3-yl)-1,3-thiazol-2-yl]cyclopropyl]methanamine.

Molecular Properties

Compound Name[1-[5-methyl-4-(1-methylpiperidin-3-yl)-1,3-thiazol-2-yl]cyclopropyl]methanamine
PubChem CID116865386
Molecular FormulaC14H23N3S
Molecular Weight265.43 g/mol
Exact Mass265.16
IUPAC Name[1-[5-methyl-4-(1-methylpiperidin-3-yl)-1,3-thiazol-2-yl]cyclopropyl]methanamine
SMILESCc1sc(C2(CN)CC2)nc1C1CCCN(C)C1
InChIInChI=1S/C14H23N3S/c1-10-12(11-4-3-7-17(2)8-11)16-13(18-10)14(9-15)5-6-14/h11H,3-9,15H2,1-2H3
InChIKeyDQHOGWNCGHMKPV-UHFFFAOYSA-N
XLogP2.25
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.43
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-methyl-4-[(3R)-1-methylpiperidin-3-yl]-1,3-thiazol-2-amine
CID 177161274
5-methyl-4-(1-methylpiperidin-3-yl)-1,3-thiazole-2-carbaldehyde
CID 116867320
[1-[4-(1-methylpiperidin-3-yl)pyrimidin-2-yl]cyclobutyl]methanamine
CID 116902705
[1-(4,5-dimethyl-1,3-thiazol-2-yl)cyclopropyl]methanamine
CID 82407544
[4-methyl-6-(1-methylpiperidin-3-yl)pyrimidin-2-yl]methanamine
CID 116892379
2-[4-methyl-6-(1-methylpiperidin-3-yl)pyrimidin-2-yl]propan-1-amine
CID 116892733
[1-[4-(4-bromophenyl)-5-methyl-1,3-thiazol-2-yl]cyclopropyl]methanamine
CID 116865366
1-(4-cyclopentyl-5-methyl-1,3-thiazol-2-yl)cyclobutane-1-carbonitrile
CID 116865599
3-(4-bromo-5-methyl-1H-pyrazol-3-yl)-1-methylpiperidine
CID 116856706
[1-(2-cyclobutyl-4-methyl-1,3-thiazol-5-yl)cyclopropyl]methanamine
CID 116886917
1-[4-methyl-2-(1-methylpiperidin-3-yl)-1,3-thiazol-5-yl]propan-2-amine
CID 116884662
formamide;2-methyl-6-(1-methylpiperidin-3-yl)thieno[2,3-b]pyridine
CID 177202390

Frequently Asked Questions

What is the IUPAC name of [1-[5-methyl-4-(1-methylpiperidin-3-yl)-1,3-thiazol-2-yl]cyclopropyl]methanamine?
The IUPAC name of [1-[5-methyl-4-(1-methylpiperidin-3-yl)-1,3-thiazol-2-yl]cyclopropyl]methanamine (CID 116865386) is [1-[5-methyl-4-(1-methylpiperidin-3-yl)-1,3-thiazol-2-yl]cyclopropyl]methanamine.
What is the SMILES notation for [1-[5-methyl-4-(1-methylpiperidin-3-yl)-1,3-thiazol-2-yl]cyclopropyl]methanamine?
The canonical SMILES for [1-[5-methyl-4-(1-methylpiperidin-3-yl)-1,3-thiazol-2-yl]cyclopropyl]methanamine is Cc1sc(C2(CN)CC2)nc1C1CCCN(C)C1.
What is the InChIKey of [1-[5-methyl-4-(1-methylpiperidin-3-yl)-1,3-thiazol-2-yl]cyclopropyl]methanamine?
The InChIKey is DQHOGWNCGHMKPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3S/c1-10-12(11-4-3-7-17(2)8-11)16-13(18-10)14(9-15)5-6-14/h11H,3-9,15H2,1-2H3.
What are the key properties of [1-[5-methyl-4-(1-methylpiperidin-3-yl)-1,3-thiazol-2-yl]cyclopropyl]methanamine?
[1-[5-methyl-4-(1-methylpiperidin-3-yl)-1,3-thiazol-2-yl]cyclopropyl]methanamine has a molecular weight of 265.43 g/mol, XLogP of 2.25, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[5-methyl-4-(1-methylpiperidin-3-yl)-1,3-thiazol-2-yl]cyclopropyl]methanamine is sourced from PubChem (CID 116865386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).