4-(4-chloro-6-piperidin-1-yl-1,3,5-triazin-2-yl)morpholine

C12H18ClN5O — CID 706598

IUPAC4-(4-chloro-6-piperidin-1-yl-1,3,5-triazin-2-yl)morpholine
SMILESClc1nc(N2CCCCC2)nc(N2CCOCC2)n1
InChIInChI=1S/C12H18ClN5O/c13-10-14-11(17-4-2-1-3-5-17)16-12(15-10)18-6-8-19-9-7-18/h1-9H2
InChIKeyDDQLGGSXQNSZHG-UHFFFAOYSA-N
MW283.76 g/mol
LogP1.35
Rot. Bonds2

About 4-(4-chloro-6-piperidin-1-yl-1,3,5-triazin-2-yl)morpholine

4-(4-chloro-6-piperidin-1-yl-1,3,5-triazin-2-yl)morpholine (PubChem CID 706598) has the molecular formula C12H18ClN5O and a molecular weight of 283.76 g/mol. Its IUPAC name is 4-(4-chloro-6-piperidin-1-yl-1,3,5-triazin-2-yl)morpholine.

Molecular Properties

Compound Name4-(4-chloro-6-piperidin-1-yl-1,3,5-triazin-2-yl)morpholine
PubChem CID706598
Molecular FormulaC12H18ClN5O
Molecular Weight283.76 g/mol
Exact Mass283.12
IUPAC Name4-(4-chloro-6-piperidin-1-yl-1,3,5-triazin-2-yl)morpholine
SMILESClc1nc(N2CCCCC2)nc(N2CCOCC2)n1
InChIInChI=1S/C12H18ClN5O/c13-10-14-11(17-4-2-1-3-5-17)16-12(15-10)18-6-8-19-9-7-18/h1-9H2
InChIKeyDDQLGGSXQNSZHG-UHFFFAOYSA-N
XLogP1.35
TPSA54.38 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.76
LogP ≤ 51.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

4-(4-Morpholinyl)-6-(1-piperidinyl)-1,3,5-triazine-2-carbonitrile
CID 729563
2-Ethoxy-4,6-dimorpholin-4-yl-1,3,5-triazine
CID 703119
(4,6-Dimorpholin-4-yl-1,3,5-triazin-2-yl)-methylcyanamide
CID 714956
(4,6-Di-piperidin-1-yl-[1,3,5]triazin-2-yloxy)-acetonitrile
CID 3158768
4,6-Dimorpholin-4-yl-1,3,5-triazin-2-amine
CID 4577604
2-Chloro-4,6-bis(morpholin-4-yl)-1,3,5-triazine
CID 224967
2-(Dimethylamino)-4,6-dimorpholino-1,3,5-triazine
CID 626291
6-Methoxy-2,4-dimorpholin-4-yl-1,3,5-triazine
CID 703118
4,6-Dimorpholino-2-trimethylammonio-sym-triazine chloride
CID 15890380
N,N-Diethyl-4,6-di-4-morpholinyl-1,3,5-triazin-2-amine
CID 678231
4-(4,6-Di(piperidin-1-yl)-1,3,5-triazin-2-yl)morpholine hydrochloride
CID 18580251
Cambridge id 5737297
CID 747104

Frequently Asked Questions

What is the IUPAC name of 4-(4-chloro-6-piperidin-1-yl-1,3,5-triazin-2-yl)morpholine?
The IUPAC name of 4-(4-chloro-6-piperidin-1-yl-1,3,5-triazin-2-yl)morpholine (CID 706598) is 4-(4-chloro-6-piperidin-1-yl-1,3,5-triazin-2-yl)morpholine.
What is the SMILES notation for 4-(4-chloro-6-piperidin-1-yl-1,3,5-triazin-2-yl)morpholine?
The canonical SMILES for 4-(4-chloro-6-piperidin-1-yl-1,3,5-triazin-2-yl)morpholine is Clc1nc(N2CCCCC2)nc(N2CCOCC2)n1.
What is the InChIKey of 4-(4-chloro-6-piperidin-1-yl-1,3,5-triazin-2-yl)morpholine?
The InChIKey is DDQLGGSXQNSZHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18ClN5O/c13-10-14-11(17-4-2-1-3-5-17)16-12(15-10)18-6-8-19-9-7-18/h1-9H2.
What are the key properties of 4-(4-chloro-6-piperidin-1-yl-1,3,5-triazin-2-yl)morpholine?
4-(4-chloro-6-piperidin-1-yl-1,3,5-triazin-2-yl)morpholine has a molecular weight of 283.76 g/mol, XLogP of 1.35, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-chloro-6-piperidin-1-yl-1,3,5-triazin-2-yl)morpholine is sourced from PubChem (CID 706598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).