6-(2-propyl-4,5-dihydro-1H-imidazol-5-yl)-1,3,5-triazine-2,4-diamine

C9H15N7 — CID 67233758

IUPAC6-(2-propyl-4,5-dihydro-1H-imidazol-5-yl)-1,3,5-triazine-2,4-diamine
SMILESCCCC1=NCC(c2nc(N)nc(N)n2)N1
InChIInChI=1S/C9H15N7/c1-2-3-6-12-4-5(13-6)7-14-8(10)16-9(11)15-7/h5H,2-4H2,1H3,(H,12,13)(H4,10,11,14,15,16)
InChIKeyXLIDILAAZJBTPH-UHFFFAOYSA-N
MW221.27 g/mol
LogP-0.12
Rot. Bonds3

About 6-(2-propyl-4,5-dihydro-1H-imidazol-5-yl)-1,3,5-triazine-2,4-diamine

6-(2-propyl-4,5-dihydro-1H-imidazol-5-yl)-1,3,5-triazine-2,4-diamine (PubChem CID 67233758) has the molecular formula C9H15N7 and a molecular weight of 221.27 g/mol. Its IUPAC name is 6-(2-propyl-4,5-dihydro-1H-imidazol-5-yl)-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name6-(2-propyl-4,5-dihydro-1H-imidazol-5-yl)-1,3,5-triazine-2,4-diamine
PubChem CID67233758
Molecular FormulaC9H15N7
Molecular Weight221.27 g/mol
Exact Mass221.14
IUPAC Name6-(2-propyl-4,5-dihydro-1H-imidazol-5-yl)-1,3,5-triazine-2,4-diamine
SMILESCCCC1=NCC(c2nc(N)nc(N)n2)N1
InChIInChI=1S/C9H15N7/c1-2-3-6-12-4-5(13-6)7-14-8(10)16-9(11)15-7/h5H,2-4H2,1H3,(H,12,13)(H4,10,11,14,15,16)
InChIKeyXLIDILAAZJBTPH-UHFFFAOYSA-N
XLogP-0.12
TPSA115.10 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.27
LogP ≤ 5-0.12
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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Related Compounds

s-Triazine, 4,6-bis(isopropylamino)-2-ethyl-
CID 33405
1,3,5-Triazin-2-amine, 4-chloro-6-ethyl-N-(1-methylethyl)-
CID 3044737
1,3,5-Triazin-2-amine, 4-chloro-N-ethyl-6-propyl-
CID 3044738
s-Triazine, 2,4-bis(isopropylamino)-6-propyl-
CID 33411
2-Ethyl-amino-4-isopropylamino-1,3,5-triazine
CID 22027372
4-(1-aminoethyl)-6-chloro-N-propan-2-yl-1,3,5-triazin-2-amine
CID 56988208
1-[4-(1-Aminoethyl)-6-methyl-1,3,5-triazin-2-yl]ethanamine
CID 68969857
6-(1-fluoroethyl)-2-N-hexan-3-yl-1,3,5-triazine-2,4-diamine
CID 18769890
6-(1-fluoroethyl)-2-N-pentan-3-yl-1,3,5-triazine-2,4-diamine
CID 18769908
2,4-Difluoro-6-piperazin-2-yl-1,3,5-triazine
CID 54463874
2-N,4-N,6-triethyl-1,3,5-triazine-2,4-diamine
CID 33404
2-N-(1-methylpyrrolidin-3-yl)-6-(trifluoromethyl)-1,3,5-triazine-2,4-diamine
CID 112746491

Frequently Asked Questions

What is the IUPAC name of 6-(2-propyl-4,5-dihydro-1H-imidazol-5-yl)-1,3,5-triazine-2,4-diamine?
The IUPAC name of 6-(2-propyl-4,5-dihydro-1H-imidazol-5-yl)-1,3,5-triazine-2,4-diamine (CID 67233758) is 6-(2-propyl-4,5-dihydro-1H-imidazol-5-yl)-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 6-(2-propyl-4,5-dihydro-1H-imidazol-5-yl)-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 6-(2-propyl-4,5-dihydro-1H-imidazol-5-yl)-1,3,5-triazine-2,4-diamine is CCCC1=NCC(c2nc(N)nc(N)n2)N1.
What is the InChIKey of 6-(2-propyl-4,5-dihydro-1H-imidazol-5-yl)-1,3,5-triazine-2,4-diamine?
The InChIKey is XLIDILAAZJBTPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N7/c1-2-3-6-12-4-5(13-6)7-14-8(10)16-9(11)15-7/h5H,2-4H2,1H3,(H,12,13)(H4,10,11,14,15,16).
What are the key properties of 6-(2-propyl-4,5-dihydro-1H-imidazol-5-yl)-1,3,5-triazine-2,4-diamine?
6-(2-propyl-4,5-dihydro-1H-imidazol-5-yl)-1,3,5-triazine-2,4-diamine has a molecular weight of 221.27 g/mol, XLogP of -0.12, 3 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-propyl-4,5-dihydro-1H-imidazol-5-yl)-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 67233758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).