2-N-cyclopropyl-6-methoxy-2-N-propyl-1,3,5-triazine-2,4-diamine

C10H17N5O — CID 80775722

IUPAC2-N-cyclopropyl-6-methoxy-2-N-propyl-1,3,5-triazine-2,4-diamine
SMILESCCCN(c1nc(N)nc(OC)n1)C1CC1
InChIInChI=1S/C10H17N5O/c1-3-6-15(7-4-5-7)9-12-8(11)13-10(14-9)16-2/h7H,3-6H2,1-2H3,(H2,11,12,13,14)
InChIKeySBXGITICTUJJFG-UHFFFAOYSA-N
MW223.28 g/mol
LogP0.84
Rot. Bonds5

About 2-N-cyclopropyl-6-methoxy-2-N-propyl-1,3,5-triazine-2,4-diamine

2-N-cyclopropyl-6-methoxy-2-N-propyl-1,3,5-triazine-2,4-diamine (PubChem CID 80775722) has the molecular formula C10H17N5O and a molecular weight of 223.28 g/mol. Its IUPAC name is 2-N-cyclopropyl-6-methoxy-2-N-propyl-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name2-N-cyclopropyl-6-methoxy-2-N-propyl-1,3,5-triazine-2,4-diamine
PubChem CID80775722
Molecular FormulaC10H17N5O
Molecular Weight223.28 g/mol
Exact Mass223.14
IUPAC Name2-N-cyclopropyl-6-methoxy-2-N-propyl-1,3,5-triazine-2,4-diamine
SMILESCCCN(c1nc(N)nc(OC)n1)C1CC1
InChIInChI=1S/C10H17N5O/c1-3-6-15(7-4-5-7)9-12-8(11)13-10(14-9)16-2/h7H,3-6H2,1-2H3,(H2,11,12,13,14)
InChIKeySBXGITICTUJJFG-UHFFFAOYSA-N
XLogP0.84
TPSA77.16 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 50.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-N-cyclopropyl-4-N-ethyl-6-methoxy-2-N-propyl-1,3,5-triazine-2,4-diamine
CID 80774290
N-(azetidin-3-yl)-4,6-dimethoxy-N-propyl-1,3,5-triazin-2-amine
CID 66213927
2-N-(4-ethylcyclohexyl)-6-methoxy-2-N-methyl-1,3,5-triazine-2,4-diamine
CID 80809819
2-N-cyclopropyl-2-N-(cyclopropylmethyl)-6-propoxy-1,3,5-triazine-2,4-diamine
CID 80844355
2-N-cyclopropyl-2-N-(cyclopropylmethyl)-6-ethoxy-1,3,5-triazine-2,4-diamine
CID 80845232
2-[(4-amino-6-ethoxy-1,3,5-triazin-2-yl)-cyclohexylamino]ethanol
CID 80811347
3-[(4-amino-6-ethoxy-1,3,5-triazin-2-yl)-cyclobutylamino]propan-1-ol
CID 102875532
2-N-cyclopropyl-6-ethoxy-2-N-(2,2,2-trifluoroethyl)-1,3,5-triazine-2,4-diamine
CID 80815110
N-(2-bromoethyl)-N-cyclopentyl-4,6-dimethoxy-1,3,5-triazin-2-amine
CID 80669323
2-N-cyclopropyl-2-N-propylpyrimidine-2,4-diamine
CID 116796417
2-N-cyclopropyl-2-N,4-N,4-N-triethyl-1,3,5-triazine-2,4,6-triamine
CID 80773987
2-N-cyclopropyl-2-N-propylpyrimidine-2,5-diamine
CID 61147883

Frequently Asked Questions

What is the IUPAC name of 2-N-cyclopropyl-6-methoxy-2-N-propyl-1,3,5-triazine-2,4-diamine?
The IUPAC name of 2-N-cyclopropyl-6-methoxy-2-N-propyl-1,3,5-triazine-2,4-diamine (CID 80775722) is 2-N-cyclopropyl-6-methoxy-2-N-propyl-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 2-N-cyclopropyl-6-methoxy-2-N-propyl-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 2-N-cyclopropyl-6-methoxy-2-N-propyl-1,3,5-triazine-2,4-diamine is CCCN(c1nc(N)nc(OC)n1)C1CC1.
What is the InChIKey of 2-N-cyclopropyl-6-methoxy-2-N-propyl-1,3,5-triazine-2,4-diamine?
The InChIKey is SBXGITICTUJJFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N5O/c1-3-6-15(7-4-5-7)9-12-8(11)13-10(14-9)16-2/h7H,3-6H2,1-2H3,(H2,11,12,13,14).
What are the key properties of 2-N-cyclopropyl-6-methoxy-2-N-propyl-1,3,5-triazine-2,4-diamine?
2-N-cyclopropyl-6-methoxy-2-N-propyl-1,3,5-triazine-2,4-diamine has a molecular weight of 223.28 g/mol, XLogP of 0.84, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-cyclopropyl-6-methoxy-2-N-propyl-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 80775722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).