N-methyl-N-(4-morpholin-4-yl-6-propyl-1,3,5-triazin-2-yl)acetamide

C13H21N5O2 — CID 3080140

IUPACN-methyl-N-(4-morpholin-4-yl-6-propyl-1,3,5-triazin-2-yl)acetamide
SMILESCCCc1nc(N2CCOCC2)nc(N(C)C(C)=O)n1
InChIInChI=1S/C13H21N5O2/c1-4-5-11-14-12(17(3)10(2)19)16-13(15-11)18-6-8-20-9-7-18/h4-9H2,1-3H3
InChIKeyOLCZQKCJFOMGKC-UHFFFAOYSA-N
MW279.34 g/mol
LogP0.64
Rot. Bonds4

About N-methyl-N-(4-morpholin-4-yl-6-propyl-1,3,5-triazin-2-yl)acetamide

N-methyl-N-(4-morpholin-4-yl-6-propyl-1,3,5-triazin-2-yl)acetamide (PubChem CID 3080140) has the molecular formula C13H21N5O2 and a molecular weight of 279.34 g/mol. Its IUPAC name is N-methyl-N-(4-morpholin-4-yl-6-propyl-1,3,5-triazin-2-yl)acetamide.

Molecular Properties

Compound NameN-methyl-N-(4-morpholin-4-yl-6-propyl-1,3,5-triazin-2-yl)acetamide
PubChem CID3080140
Molecular FormulaC13H21N5O2
Molecular Weight279.34 g/mol
Exact Mass279.17
IUPAC NameN-methyl-N-(4-morpholin-4-yl-6-propyl-1,3,5-triazin-2-yl)acetamide
SMILESCCCc1nc(N2CCOCC2)nc(N(C)C(C)=O)n1
InChIInChI=1S/C13H21N5O2/c1-4-5-11-14-12(17(3)10(2)19)16-13(15-11)18-6-8-20-9-7-18/h4-9H2,1-3H3
InChIKeyOLCZQKCJFOMGKC-UHFFFAOYSA-N
XLogP0.64
TPSA71.45 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.34
LogP ≤ 50.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(4-morpholin-4-yl-6-propyl-1,3,5-triazin-2-yl)acetamide?
The IUPAC name of N-methyl-N-(4-morpholin-4-yl-6-propyl-1,3,5-triazin-2-yl)acetamide (CID 3080140) is N-methyl-N-(4-morpholin-4-yl-6-propyl-1,3,5-triazin-2-yl)acetamide.
What is the SMILES notation for N-methyl-N-(4-morpholin-4-yl-6-propyl-1,3,5-triazin-2-yl)acetamide?
The canonical SMILES for N-methyl-N-(4-morpholin-4-yl-6-propyl-1,3,5-triazin-2-yl)acetamide is CCCc1nc(N2CCOCC2)nc(N(C)C(C)=O)n1.
What is the InChIKey of N-methyl-N-(4-morpholin-4-yl-6-propyl-1,3,5-triazin-2-yl)acetamide?
The InChIKey is OLCZQKCJFOMGKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N5O2/c1-4-5-11-14-12(17(3)10(2)19)16-13(15-11)18-6-8-20-9-7-18/h4-9H2,1-3H3.
What are the key properties of N-methyl-N-(4-morpholin-4-yl-6-propyl-1,3,5-triazin-2-yl)acetamide?
N-methyl-N-(4-morpholin-4-yl-6-propyl-1,3,5-triazin-2-yl)acetamide has a molecular weight of 279.34 g/mol, XLogP of 0.64, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(4-morpholin-4-yl-6-propyl-1,3,5-triazin-2-yl)acetamide is sourced from PubChem (CID 3080140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).