4-morpholin-4-yl-6-propyl-1,3,5-triazin-2-amine;hydrochloride

C10H18ClN5O — CID 3080165

IUPAC4-morpholin-4-yl-6-propyl-1,3,5-triazin-2-amine;hydrochloride
SMILESCCCc1nc(N)nc(N2CCOCC2)n1.Cl
InChIInChI=1S/C10H17N5O.ClH/c1-2-3-8-12-9(11)14-10(13-8)15-4-6-16-7-5-15;/h2-7H2,1H3,(H2,11,12,13,14);1H
InChIKeyJFPVTWREDPPVPB-UHFFFAOYSA-N
MW259.74 g/mol
LogP0.66
Rot. Bonds3

About 4-morpholin-4-yl-6-propyl-1,3,5-triazin-2-amine;hydrochloride

4-morpholin-4-yl-6-propyl-1,3,5-triazin-2-amine;hydrochloride (PubChem CID 3080165) has the molecular formula C10H18ClN5O and a molecular weight of 259.74 g/mol. Its IUPAC name is 4-morpholin-4-yl-6-propyl-1,3,5-triazin-2-amine;hydrochloride.

Molecular Properties

Compound Name4-morpholin-4-yl-6-propyl-1,3,5-triazin-2-amine;hydrochloride
PubChem CID3080165
Molecular FormulaC10H18ClN5O
Molecular Weight259.74 g/mol
Exact Mass259.12
IUPAC Name4-morpholin-4-yl-6-propyl-1,3,5-triazin-2-amine;hydrochloride
SMILESCCCc1nc(N)nc(N2CCOCC2)n1.Cl
InChIInChI=1S/C10H17N5O.ClH/c1-2-3-8-12-9(11)14-10(13-8)15-4-6-16-7-5-15;/h2-7H2,1H3,(H2,11,12,13,14);1H
InChIKeyJFPVTWREDPPVPB-UHFFFAOYSA-N
XLogP0.66
TPSA77.16 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.74
LogP ≤ 50.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

s-Triazine, 2-amino-4-(chloromethyl)-6-morpholino-
CID 210892
2-(4-Morpholino-6-propyl-1,3,5-triazin-2-yl)aminoethanol
CID 130928
N-Cyclopropyl-6-(morpholin-4-yl)-4-propyl-1,3,5-triazin-2(1H)-imine
CID 192460
4-(Diethylamino)-6-morpholin-4-yl-1,3,5-triazine-2-carbonitrile
CID 1521564
1,3,5-Triazin-2-amine, 4-methoxy-6-(4-morpholinylmethyl)-
CID 199954
s-Triazine, 2-amino-4-morpholino-6-(piperidinomethyl)-
CID 210895
s-Triazine, 2-amino-4-(morpholinomethyl)-6-piperidino-
CID 210896
s-Triazine, 2,4-dimorpholino-6-methyl-
CID 33387
1,3,5-Triazin-2-amine, N,4-dicyclopropyl-6-(4-morpholinyl)-, monohydrochloride
CID 3073348
1,3,5-Triazin-2(1H)-one, 4-(4-morpholinyl)-6-propyl-, oxime
CID 3080117
2-Propanol, 1-((4-(4-morpholinyl)-6-propyl-1,3,5-triazin-2-yl)amino)-
CID 3080120
2-Propanol, 1-((4-(4-morpholinyl)-6-propyl-1,3,5-triazin-2-yl)amino)-, (S)-
CID 3080129

Frequently Asked Questions

What is the IUPAC name of 4-morpholin-4-yl-6-propyl-1,3,5-triazin-2-amine;hydrochloride?
The IUPAC name of 4-morpholin-4-yl-6-propyl-1,3,5-triazin-2-amine;hydrochloride (CID 3080165) is 4-morpholin-4-yl-6-propyl-1,3,5-triazin-2-amine;hydrochloride.
What is the SMILES notation for 4-morpholin-4-yl-6-propyl-1,3,5-triazin-2-amine;hydrochloride?
The canonical SMILES for 4-morpholin-4-yl-6-propyl-1,3,5-triazin-2-amine;hydrochloride is CCCc1nc(N)nc(N2CCOCC2)n1.Cl.
What is the InChIKey of 4-morpholin-4-yl-6-propyl-1,3,5-triazin-2-amine;hydrochloride?
The InChIKey is JFPVTWREDPPVPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N5O.ClH/c1-2-3-8-12-9(11)14-10(13-8)15-4-6-16-7-5-15;/h2-7H2,1H3,(H2,11,12,13,14);1H.
What are the key properties of 4-morpholin-4-yl-6-propyl-1,3,5-triazin-2-amine;hydrochloride?
4-morpholin-4-yl-6-propyl-1,3,5-triazin-2-amine;hydrochloride has a molecular weight of 259.74 g/mol, XLogP of 0.66, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-morpholin-4-yl-6-propyl-1,3,5-triazin-2-amine;hydrochloride is sourced from PubChem (CID 3080165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).