4-cycloheptyl-6-morpholin-4-yl-1,3,5-triazin-2-amine

C14H23N5O — CID 63867478

IUPAC4-cycloheptyl-6-morpholin-4-yl-1,3,5-triazin-2-amine
SMILESNc1nc(C2CCCCCC2)nc(N2CCOCC2)n1
InChIInChI=1S/C14H23N5O/c15-13-16-12(11-5-3-1-2-4-6-11)17-14(18-13)19-7-9-20-10-8-19/h11H,1-10H2,(H2,15,16,17,18)
InChIKeyIDQRKILYPAIWTM-UHFFFAOYSA-N
MW277.37 g/mol
LogP1.73
Rot. Bonds2

About 4-cycloheptyl-6-morpholin-4-yl-1,3,5-triazin-2-amine

4-cycloheptyl-6-morpholin-4-yl-1,3,5-triazin-2-amine (PubChem CID 63867478) has the molecular formula C14H23N5O and a molecular weight of 277.37 g/mol. Its IUPAC name is 4-cycloheptyl-6-morpholin-4-yl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-cycloheptyl-6-morpholin-4-yl-1,3,5-triazin-2-amine
PubChem CID63867478
Molecular FormulaC14H23N5O
Molecular Weight277.37 g/mol
Exact Mass277.19
IUPAC Name4-cycloheptyl-6-morpholin-4-yl-1,3,5-triazin-2-amine
SMILESNc1nc(C2CCCCCC2)nc(N2CCOCC2)n1
InChIInChI=1S/C14H23N5O/c15-13-16-12(11-5-3-1-2-4-6-11)17-14(18-13)19-7-9-20-10-8-19/h11H,1-10H2,(H2,15,16,17,18)
InChIKeyIDQRKILYPAIWTM-UHFFFAOYSA-N
XLogP1.73
TPSA77.16 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-Cycloheptyl-6-(2,2,2-trifluoroethoxymethyl)-1,3,5-triazin-2-amine
CID 103476944
4-Morpholin-4-yl-6-tridecyl-1,3,5-triazin-2-amine
CID 314589
4-Heptyl-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 314590
4-Morpholin-4-yl-6-pentyl-1,3,5-triazin-2-amine
CID 22166508
O-[4-cycloheptyl-6-[methyl-(1-methylpiperidin-2-yl)amino]-1,3,5-triazin-2-yl]hydroxylamine
CID 69713954
4-(Cyclohexylmethylamino)-6-morpholin-4-yl-1,3,5-triazine-2-carbonitrile
CID 69716417
N-(3-cyclobutylpropyl)-4-cyclopropyl-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 118045119
4-Dodecyl-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 124035331
4-Cyclopentyl-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 9992258
4-Cyclohexyl-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 55251815
4-Cycloheptyl-6-(propoxymethyl)-1,3,5-triazin-2-amine
CID 55252116
4-Cycloheptyl-6-piperidin-1-yl-1,3,5-triazin-2-amine
CID 63868501

Frequently Asked Questions

What is the IUPAC name of 4-cycloheptyl-6-morpholin-4-yl-1,3,5-triazin-2-amine?
The IUPAC name of 4-cycloheptyl-6-morpholin-4-yl-1,3,5-triazin-2-amine (CID 63867478) is 4-cycloheptyl-6-morpholin-4-yl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-cycloheptyl-6-morpholin-4-yl-1,3,5-triazin-2-amine?
The canonical SMILES for 4-cycloheptyl-6-morpholin-4-yl-1,3,5-triazin-2-amine is Nc1nc(C2CCCCCC2)nc(N2CCOCC2)n1.
What is the InChIKey of 4-cycloheptyl-6-morpholin-4-yl-1,3,5-triazin-2-amine?
The InChIKey is IDQRKILYPAIWTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N5O/c15-13-16-12(11-5-3-1-2-4-6-11)17-14(18-13)19-7-9-20-10-8-19/h11H,1-10H2,(H2,15,16,17,18).
What are the key properties of 4-cycloheptyl-6-morpholin-4-yl-1,3,5-triazin-2-amine?
4-cycloheptyl-6-morpholin-4-yl-1,3,5-triazin-2-amine has a molecular weight of 277.37 g/mol, XLogP of 1.73, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cycloheptyl-6-morpholin-4-yl-1,3,5-triazin-2-amine is sourced from PubChem (CID 63867478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).