4-chloro-6-(4-methoxy-2-methylpiperidin-1-yl)-N,N-dimethyl-1,3,5-triazin-2-amine

C12H20ClN5O — CID 114221418

IUPAC4-chloro-6-(4-methoxy-2-methylpiperidin-1-yl)-N,N-dimethyl-1,3,5-triazin-2-amine
SMILESCOC1CCN(c2nc(Cl)nc(N(C)C)n2)C(C)C1
InChIInChI=1S/C12H20ClN5O/c1-8-7-9(19-4)5-6-18(8)12-15-10(13)14-11(16-12)17(2)3/h8-9H,5-7H2,1-4H3
InChIKeyDUEDOIAPSMOXCE-UHFFFAOYSA-N
MW285.78 g/mol
LogP1.59
Rot. Bonds3

About 4-chloro-6-(4-methoxy-2-methylpiperidin-1-yl)-N,N-dimethyl-1,3,5-triazin-2-amine

4-chloro-6-(4-methoxy-2-methylpiperidin-1-yl)-N,N-dimethyl-1,3,5-triazin-2-amine (PubChem CID 114221418) has the molecular formula C12H20ClN5O and a molecular weight of 285.78 g/mol. Its IUPAC name is 4-chloro-6-(4-methoxy-2-methylpiperidin-1-yl)-N,N-dimethyl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-chloro-6-(4-methoxy-2-methylpiperidin-1-yl)-N,N-dimethyl-1,3,5-triazin-2-amine
PubChem CID114221418
Molecular FormulaC12H20ClN5O
Molecular Weight285.78 g/mol
Exact Mass285.14
IUPAC Name4-chloro-6-(4-methoxy-2-methylpiperidin-1-yl)-N,N-dimethyl-1,3,5-triazin-2-amine
SMILESCOC1CCN(c2nc(Cl)nc(N(C)C)n2)C(C)C1
InChIInChI=1S/C12H20ClN5O/c1-8-7-9(19-4)5-6-18(8)12-15-10(13)14-11(16-12)17(2)3/h8-9H,5-7H2,1-4H3
InChIKeyDUEDOIAPSMOXCE-UHFFFAOYSA-N
XLogP1.59
TPSA54.38 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.78
LogP ≤ 51.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 4-chloro-6-(4-methoxy-2-methylpiperidin-1-yl)-N,N-dimethyl-1,3,5-triazin-2-amine with MolForge

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Launch Full Analysis

Related Compounds

4-chloro-2-cyclopropyl-6-[(2R,4S)-4-methoxy-2-methylpiperidin-1-yl]pyrimidine
CID 124850877
4-chloro-N,N-dimethyl-6-(1-methylpiperidin-4-yl)oxy-1,3,5-triazin-2-amine
CID 62870341
4-chloro-N,N-diethyl-6-(4-methoxypiperidin-1-yl)-1,3,5-triazin-2-amine
CID 62863161
5,6-diethyl-3-[(2S,4S)-4-methoxy-2-methylpiperidin-1-yl]-1,2,4-triazine
CID 124872866
2-(4-methoxy-2-methylpiperidin-1-yl)pyrimidine-4-carboxylic acid
CID 114221598
2,4-dichloro-6-(4-methoxypiperidin-1-yl)-1,3,5-triazine
CID 62869567
6-(4-methoxypiperidin-1-yl)-4-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine
CID 80783413
6-(2,4-dimethylpiperidin-1-yl)-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine
CID 80826737
4-chloro-N,N-dimethyl-6-piperidin-1-yl-1,3,5-triazin-2-amine
CID 10681597
4-chloro-N,N-dimethyl-6-thiomorpholin-4-yl-1,3,5-triazin-2-amine
CID 62868516
4-chloro-N,N-dimethyl-6-(2-methyl-2,3-dihydroindol-1-yl)-1,3,5-triazin-2-amine
CID 62869999
4-chloro-6-(2,4-dimethylpiperidin-1-yl)-N-methyl-1,3,5-triazin-2-amine
CID 80826625

Frequently Asked Questions

What is the IUPAC name of 4-chloro-6-(4-methoxy-2-methylpiperidin-1-yl)-N,N-dimethyl-1,3,5-triazin-2-amine?
The IUPAC name of 4-chloro-6-(4-methoxy-2-methylpiperidin-1-yl)-N,N-dimethyl-1,3,5-triazin-2-amine (CID 114221418) is 4-chloro-6-(4-methoxy-2-methylpiperidin-1-yl)-N,N-dimethyl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-chloro-6-(4-methoxy-2-methylpiperidin-1-yl)-N,N-dimethyl-1,3,5-triazin-2-amine?
The canonical SMILES for 4-chloro-6-(4-methoxy-2-methylpiperidin-1-yl)-N,N-dimethyl-1,3,5-triazin-2-amine is COC1CCN(c2nc(Cl)nc(N(C)C)n2)C(C)C1.
What is the InChIKey of 4-chloro-6-(4-methoxy-2-methylpiperidin-1-yl)-N,N-dimethyl-1,3,5-triazin-2-amine?
The InChIKey is DUEDOIAPSMOXCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20ClN5O/c1-8-7-9(19-4)5-6-18(8)12-15-10(13)14-11(16-12)17(2)3/h8-9H,5-7H2,1-4H3.
What are the key properties of 4-chloro-6-(4-methoxy-2-methylpiperidin-1-yl)-N,N-dimethyl-1,3,5-triazin-2-amine?
4-chloro-6-(4-methoxy-2-methylpiperidin-1-yl)-N,N-dimethyl-1,3,5-triazin-2-amine has a molecular weight of 285.78 g/mol, XLogP of 1.59, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-6-(4-methoxy-2-methylpiperidin-1-yl)-N,N-dimethyl-1,3,5-triazin-2-amine is sourced from PubChem (CID 114221418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).