6-propan-2-yl-1,3,5-triazine-2,4-diamine

C6H11N5 — CID 21498

IUPAC6-propan-2-yl-1,3,5-triazine-2,4-diamine
SMILESCC(C)c1nc(N)nc(N)n1
InChIInChI=1S/C6H11N5/c1-3(2)4-9-5(7)11-6(8)10-4/h3H,1-2H3,(H4,7,8,9,10,11)
InChIKeyOOEGQLPPMITCBZ-UHFFFAOYSA-N
MW153.19 g/mol
LogP0.16
Rot. Bonds1

About 6-propan-2-yl-1,3,5-triazine-2,4-diamine

6-propan-2-yl-1,3,5-triazine-2,4-diamine (PubChem CID 21498) has the molecular formula C6H11N5 and a molecular weight of 153.19 g/mol. Its IUPAC name is 6-propan-2-yl-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name6-propan-2-yl-1,3,5-triazine-2,4-diamine
PubChem CID21498
Molecular FormulaC6H11N5
Molecular Weight153.19 g/mol
Exact Mass153.10
IUPAC Name6-propan-2-yl-1,3,5-triazine-2,4-diamine
SMILESCC(C)c1nc(N)nc(N)n1
InChIInChI=1S/C6H11N5/c1-3(2)4-9-5(7)11-6(8)10-4/h3H,1-2H3,(H4,7,8,9,10,11)
InChIKeyOOEGQLPPMITCBZ-UHFFFAOYSA-N
XLogP0.16
TPSA90.71 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.19
LogP ≤ 50.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

Acetoguanamine
CID 10949
Dimethyl-1,3,5-triazin-2-amine
CID 15820
4-(Methylsulfanyl)-6-(propan-2-yl)-1,3,5-triazin-2-amine
CID 2782086
4-Ethyl-6-methoxy-1,3,5-triazin-2-amine
CID 69701
6-Ethyl-1,3,5-triazine-2,4-diamine
CID 13628
6-Propyl-1,3,5-triazine-2,4-diamine
CID 22252
4-Cyclopropyl-6-methoxy-1,3,5-triazin-2-amine
CID 2726591
1,3,5-Triazin-2-amine, 4-methoxy-6-propyl-
CID 199263
6-Cyclopropyl-1,3,5-triazine-2,4(1H,3H)-diimine
CID 212661
6-Pentyl-1,3,5-triazine-2,4-diamine
CID 18673
2,4-Dichloro-6-(propan-2-yl)-1,3,5-triazine
CID 35648
2,4,6-Triethyltriazine
CID 13889

Frequently Asked Questions

What is the IUPAC name of 6-propan-2-yl-1,3,5-triazine-2,4-diamine?
The IUPAC name of 6-propan-2-yl-1,3,5-triazine-2,4-diamine (CID 21498) is 6-propan-2-yl-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 6-propan-2-yl-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 6-propan-2-yl-1,3,5-triazine-2,4-diamine is CC(C)c1nc(N)nc(N)n1.
What is the InChIKey of 6-propan-2-yl-1,3,5-triazine-2,4-diamine?
The InChIKey is OOEGQLPPMITCBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N5/c1-3(2)4-9-5(7)11-6(8)10-4/h3H,1-2H3,(H4,7,8,9,10,11).
What are the key properties of 6-propan-2-yl-1,3,5-triazine-2,4-diamine?
6-propan-2-yl-1,3,5-triazine-2,4-diamine has a molecular weight of 153.19 g/mol, XLogP of 0.16, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-propan-2-yl-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 21498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).