2-(4-amino-6-propyl-1,3,5-triazin-2-yl)acetamide

C8H13N5O — CID 63868184

IUPAC2-(4-amino-6-propyl-1,3,5-triazin-2-yl)acetamide
SMILESCCCc1nc(N)nc(CC(N)=O)n1
InChIInChI=1S/C8H13N5O/c1-2-3-6-11-7(4-5(9)14)13-8(10)12-6/h2-4H2,1H3,(H2,9,14)(H2,10,11,12,13)
InChIKeyNSTAUPMQSHROKY-UHFFFAOYSA-N
MW195.23 g/mol
LogP-0.57
Rot. Bonds4

About 2-(4-amino-6-propyl-1,3,5-triazin-2-yl)acetamide

2-(4-amino-6-propyl-1,3,5-triazin-2-yl)acetamide (PubChem CID 63868184) has the molecular formula C8H13N5O and a molecular weight of 195.23 g/mol. Its IUPAC name is 2-(4-amino-6-propyl-1,3,5-triazin-2-yl)acetamide.

Molecular Properties

Compound Name2-(4-amino-6-propyl-1,3,5-triazin-2-yl)acetamide
PubChem CID63868184
Molecular FormulaC8H13N5O
Molecular Weight195.23 g/mol
Exact Mass195.11
IUPAC Name2-(4-amino-6-propyl-1,3,5-triazin-2-yl)acetamide
SMILESCCCc1nc(N)nc(CC(N)=O)n1
InChIInChI=1S/C8H13N5O/c1-2-3-6-11-7(4-5(9)14)13-8(10)12-6/h2-4H2,1H3,(H2,9,14)(H2,10,11,12,13)
InChIKeyNSTAUPMQSHROKY-UHFFFAOYSA-N
XLogP-0.57
TPSA107.78 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.23
LogP ≤ 5-0.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1-(4,6-Dimethyl-1,3,5-triazin-2-yl)propan-2-one
CID 21813315
Acetamide, N-(4-amino-6-propyl-1,3,5-triazin-2-yl)-
CID 190423
Pentanamide, N-(4-amino-6-propyl-1,3,5-triazin-2-yl)-
CID 190424
3-(4,6-Diamino-1,3,5-triazin-2-yl)propanamide
CID 232991
N-(4-amino-6-propyl-1,3,5-triazin-2-yl)propanamide
CID 13574307
N-(4-amino-6-propyl-1,3,5-triazin-2-yl)-2-methylpropanamide
CID 13574309
2-(4,6-Diamino-1,3,5-triazin-2-yl)acetamide
CID 5069845
N,N-dibromo-2-(4,6-diamino-1,3,5-triazin-2-yl)acetamide
CID 20487995
4-Amino-6-propyl-1,3,5-triazine-2-carboxamide
CID 90380601
N-[4-methyl-6-(propanoylamino)-1,3,5-triazin-2-yl]propanamide
CID 118672144
1-(4,6-Diamino-1,3,5-triazin-2-yl)propan-2-one
CID 34924
N-(4-amino-6-propyl-1,3,5-triazin-2-yl)butanamide
CID 13574308

Frequently Asked Questions

What is the IUPAC name of 2-(4-amino-6-propyl-1,3,5-triazin-2-yl)acetamide?
The IUPAC name of 2-(4-amino-6-propyl-1,3,5-triazin-2-yl)acetamide (CID 63868184) is 2-(4-amino-6-propyl-1,3,5-triazin-2-yl)acetamide.
What is the SMILES notation for 2-(4-amino-6-propyl-1,3,5-triazin-2-yl)acetamide?
The canonical SMILES for 2-(4-amino-6-propyl-1,3,5-triazin-2-yl)acetamide is CCCc1nc(N)nc(CC(N)=O)n1.
What is the InChIKey of 2-(4-amino-6-propyl-1,3,5-triazin-2-yl)acetamide?
The InChIKey is NSTAUPMQSHROKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N5O/c1-2-3-6-11-7(4-5(9)14)13-8(10)12-6/h2-4H2,1H3,(H2,9,14)(H2,10,11,12,13).
What are the key properties of 2-(4-amino-6-propyl-1,3,5-triazin-2-yl)acetamide?
2-(4-amino-6-propyl-1,3,5-triazin-2-yl)acetamide has a molecular weight of 195.23 g/mol, XLogP of -0.57, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-amino-6-propyl-1,3,5-triazin-2-yl)acetamide is sourced from PubChem (CID 63868184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).