4-(4-methoxypiperidin-1-yl)-N,N-dimethyl-6-propan-2-yl-1,3,5-triazin-2-amine

C14H25N5O — CID 133434243

IUPAC4-(4-methoxypiperidin-1-yl)-N,N-dimethyl-6-propan-2-yl-1,3,5-triazin-2-amine
SMILESCOC1CCN(c2nc(C(C)C)nc(N(C)C)n2)CC1
InChIInChI=1S/C14H25N5O/c1-10(2)12-15-13(18(3)4)17-14(16-12)19-8-6-11(20-5)7-9-19/h10-11H,6-9H2,1-5H3
InChIKeyGBTLJLOPBCWHCV-UHFFFAOYSA-N
MW279.39 g/mol
LogP1.68
Rot. Bonds4

About 4-(4-methoxypiperidin-1-yl)-N,N-dimethyl-6-propan-2-yl-1,3,5-triazin-2-amine

4-(4-methoxypiperidin-1-yl)-N,N-dimethyl-6-propan-2-yl-1,3,5-triazin-2-amine (PubChem CID 133434243) has the molecular formula C14H25N5O and a molecular weight of 279.39 g/mol. Its IUPAC name is 4-(4-methoxypiperidin-1-yl)-N,N-dimethyl-6-propan-2-yl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-(4-methoxypiperidin-1-yl)-N,N-dimethyl-6-propan-2-yl-1,3,5-triazin-2-amine
PubChem CID133434243
Molecular FormulaC14H25N5O
Molecular Weight279.39 g/mol
Exact Mass279.21
IUPAC Name4-(4-methoxypiperidin-1-yl)-N,N-dimethyl-6-propan-2-yl-1,3,5-triazin-2-amine
SMILESCOC1CCN(c2nc(C(C)C)nc(N(C)C)n2)CC1
InChIInChI=1S/C14H25N5O/c1-10(2)12-15-13(18(3)4)17-14(16-12)19-8-6-11(20-5)7-9-19/h10-11H,6-9H2,1-5H3
InChIKeyGBTLJLOPBCWHCV-UHFFFAOYSA-N
XLogP1.68
TPSA54.38 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.39
LogP ≤ 51.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-(4-methoxypiperidin-1-yl)-N,N-dimethyl-6-propan-2-yl-1,3,5-triazin-2-amine?
The IUPAC name of 4-(4-methoxypiperidin-1-yl)-N,N-dimethyl-6-propan-2-yl-1,3,5-triazin-2-amine (CID 133434243) is 4-(4-methoxypiperidin-1-yl)-N,N-dimethyl-6-propan-2-yl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-(4-methoxypiperidin-1-yl)-N,N-dimethyl-6-propan-2-yl-1,3,5-triazin-2-amine?
The canonical SMILES for 4-(4-methoxypiperidin-1-yl)-N,N-dimethyl-6-propan-2-yl-1,3,5-triazin-2-amine is COC1CCN(c2nc(C(C)C)nc(N(C)C)n2)CC1.
What is the InChIKey of 4-(4-methoxypiperidin-1-yl)-N,N-dimethyl-6-propan-2-yl-1,3,5-triazin-2-amine?
The InChIKey is GBTLJLOPBCWHCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N5O/c1-10(2)12-15-13(18(3)4)17-14(16-12)19-8-6-11(20-5)7-9-19/h10-11H,6-9H2,1-5H3.
What are the key properties of 4-(4-methoxypiperidin-1-yl)-N,N-dimethyl-6-propan-2-yl-1,3,5-triazin-2-amine?
4-(4-methoxypiperidin-1-yl)-N,N-dimethyl-6-propan-2-yl-1,3,5-triazin-2-amine has a molecular weight of 279.39 g/mol, XLogP of 1.68, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-methoxypiperidin-1-yl)-N,N-dimethyl-6-propan-2-yl-1,3,5-triazin-2-amine is sourced from PubChem (CID 133434243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).