1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N-[(4-methoxyphenyl)methyl]piperidine-4-carboxamide

C19H25N5O4 — CID 3222665

IUPAC1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N-[(4-methoxyphenyl)methyl]piperidine-4-carboxamide
SMILESCOc1ccc(CNC(=O)C2CCN(c3nc(OC)nc(OC)n3)CC2)cc1
InChIInChI=1S/C19H25N5O4/c1-26-15-6-4-13(5-7-15)12-20-16(25)14-8-10-24(11-9-14)17-21-18(27-2)23-19(22-17)28-3/h4-7,14H,8-12H2,1-3H3,(H,20,25)
InChIKeyMJUZXKPNBBBDPU-UHFFFAOYSA-N
MW387.44 g/mol
LogP1.43
Rot. Bonds7

About 1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N-[(4-methoxyphenyl)methyl]piperidine-4-carboxamide

1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N-[(4-methoxyphenyl)methyl]piperidine-4-carboxamide (PubChem CID 3222665) has the molecular formula C19H25N5O4 and a molecular weight of 387.44 g/mol. Its IUPAC name is 1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N-[(4-methoxyphenyl)methyl]piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N-[(4-methoxyphenyl)methyl]piperidine-4-carboxamide
PubChem CID3222665
Molecular FormulaC19H25N5O4
Molecular Weight387.44 g/mol
Exact Mass387.19
IUPAC Name1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N-[(4-methoxyphenyl)methyl]piperidine-4-carboxamide
SMILESCOc1ccc(CNC(=O)C2CCN(c3nc(OC)nc(OC)n3)CC2)cc1
InChIInChI=1S/C19H25N5O4/c1-26-15-6-4-13(5-7-15)12-20-16(25)14-8-10-24(11-9-14)17-21-18(27-2)23-19(22-17)28-3/h4-7,14H,8-12H2,1-3H3,(H,20,25)
InChIKeyMJUZXKPNBBBDPU-UHFFFAOYSA-N
XLogP1.43
TPSA98.70 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.44
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of 1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N-[(4-methoxyphenyl)methyl]piperidine-4-carboxamide?
The IUPAC name of 1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N-[(4-methoxyphenyl)methyl]piperidine-4-carboxamide (CID 3222665) is 1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N-[(4-methoxyphenyl)methyl]piperidine-4-carboxamide.
What is the SMILES notation for 1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N-[(4-methoxyphenyl)methyl]piperidine-4-carboxamide?
The canonical SMILES for 1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N-[(4-methoxyphenyl)methyl]piperidine-4-carboxamide is COc1ccc(CNC(=O)C2CCN(c3nc(OC)nc(OC)n3)CC2)cc1.
What is the InChIKey of 1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N-[(4-methoxyphenyl)methyl]piperidine-4-carboxamide?
The InChIKey is MJUZXKPNBBBDPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N5O4/c1-26-15-6-4-13(5-7-15)12-20-16(25)14-8-10-24(11-9-14)17-21-18(27-2)23-19(22-17)28-3/h4-7,14H,8-12H2,1-3H3,(H,20,25).
What are the key properties of 1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N-[(4-methoxyphenyl)methyl]piperidine-4-carboxamide?
1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N-[(4-methoxyphenyl)methyl]piperidine-4-carboxamide has a molecular weight of 387.44 g/mol, XLogP of 1.43, 7 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N-[(4-methoxyphenyl)methyl]piperidine-4-carboxamide is sourced from PubChem (CID 3222665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).