6-methoxy-2-N-methyl-2-N-(4-methylpentan-2-yl)-4-N-propyl-1,3,5-triazine-2,4-diamine

C14H27N5O — CID 80810740

IUPAC6-methoxy-2-N-methyl-2-N-(4-methylpentan-2-yl)-4-N-propyl-1,3,5-triazine-2,4-diamine
SMILESCCCNc1nc(OC)nc(N(C)C(C)CC(C)C)n1
InChIInChI=1S/C14H27N5O/c1-7-8-15-12-16-13(18-14(17-12)20-6)19(5)11(4)9-10(2)3/h10-11H,7-9H2,1-6H3,(H,15,16,17,18)
InChIKeyDPRXMHUJFFGRSN-UHFFFAOYSA-N
MW281.40 g/mol
LogP2.57
Rot. Bonds8

About 6-methoxy-2-N-methyl-2-N-(4-methylpentan-2-yl)-4-N-propyl-1,3,5-triazine-2,4-diamine

6-methoxy-2-N-methyl-2-N-(4-methylpentan-2-yl)-4-N-propyl-1,3,5-triazine-2,4-diamine (PubChem CID 80810740) has the molecular formula C14H27N5O and a molecular weight of 281.40 g/mol. Its IUPAC name is 6-methoxy-2-N-methyl-2-N-(4-methylpentan-2-yl)-4-N-propyl-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name6-methoxy-2-N-methyl-2-N-(4-methylpentan-2-yl)-4-N-propyl-1,3,5-triazine-2,4-diamine
PubChem CID80810740
Molecular FormulaC14H27N5O
Molecular Weight281.40 g/mol
Exact Mass281.22
IUPAC Name6-methoxy-2-N-methyl-2-N-(4-methylpentan-2-yl)-4-N-propyl-1,3,5-triazine-2,4-diamine
SMILESCCCNc1nc(OC)nc(N(C)C(C)CC(C)C)n1
InChIInChI=1S/C14H27N5O/c1-7-8-15-12-16-13(18-14(17-12)20-6)19(5)11(4)9-10(2)3/h10-11H,7-9H2,1-6H3,(H,15,16,17,18)
InChIKeyDPRXMHUJFFGRSN-UHFFFAOYSA-N
XLogP2.57
TPSA63.17 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 6-methoxy-2-N-methyl-2-N-(4-methylpentan-2-yl)-4-N-propyl-1,3,5-triazine-2,4-diamine with MolForge

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Related Compounds

6-methoxy-2-N-methyl-2-N-(3-methylbutan-2-yl)-4-N-propyl-1,3,5-triazine-2,4-diamine
CID 80793517
2-N-methyl-2-N-propan-2-yl-6-propan-2-yloxy-4-N-propyl-1,3,5-triazine-2,4-diamine
CID 80764899
6-ethoxy-2-N-(1-methoxypropan-2-yl)-2-N-methyl-4-N-propyl-1,3,5-triazine-2,4-diamine
CID 80808604
1-[[4-methoxy-6-(propylamino)-1,3,5-triazin-2-yl]amino]-4-methylpentan-2-ol
CID 107159645
6-ethoxy-2-N-methyl-2-N-(1-methylsulfanylpropan-2-yl)-4-N-propyl-1,3,5-triazine-2,4-diamine
CID 115988830
2-N-butan-2-yl-6-methoxy-2-N-(2-methoxyethyl)-4-N-propyl-1,3,5-triazine-2,4-diamine
CID 80787122
2-N-(3,3-dimethylbutan-2-yl)-4-N-ethyl-6-methoxy-2-N-methyl-1,3,5-triazine-2,4-diamine
CID 80815170
6-methoxy-2-N-methyl-2-N-(2-methylphenyl)-4-N-propyl-1,3,5-triazine-2,4-diamine
CID 80795943
4-N-ethyl-6-methoxy-2-N-propan-2-yl-2-N-propyl-1,3,5-triazine-2,4-diamine
CID 80776462
2-[[4-methoxy-6-(propylamino)-1,3,5-triazin-2-yl]amino]propan-1-ol
CID 80780126
1-[ethyl-[4-methoxy-6-(propylamino)-1,3,5-triazin-2-yl]amino]-2-methylpropan-2-ol
CID 80848621
2-N,2-N-dimethyl-6-propoxy-4-N-propyl-1,3,5-triazine-2,4-diamine
CID 80766033

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-2-N-methyl-2-N-(4-methylpentan-2-yl)-4-N-propyl-1,3,5-triazine-2,4-diamine?
The IUPAC name of 6-methoxy-2-N-methyl-2-N-(4-methylpentan-2-yl)-4-N-propyl-1,3,5-triazine-2,4-diamine (CID 80810740) is 6-methoxy-2-N-methyl-2-N-(4-methylpentan-2-yl)-4-N-propyl-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 6-methoxy-2-N-methyl-2-N-(4-methylpentan-2-yl)-4-N-propyl-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 6-methoxy-2-N-methyl-2-N-(4-methylpentan-2-yl)-4-N-propyl-1,3,5-triazine-2,4-diamine is CCCNc1nc(OC)nc(N(C)C(C)CC(C)C)n1.
What is the InChIKey of 6-methoxy-2-N-methyl-2-N-(4-methylpentan-2-yl)-4-N-propyl-1,3,5-triazine-2,4-diamine?
The InChIKey is DPRXMHUJFFGRSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N5O/c1-7-8-15-12-16-13(18-14(17-12)20-6)19(5)11(4)9-10(2)3/h10-11H,7-9H2,1-6H3,(H,15,16,17,18).
What are the key properties of 6-methoxy-2-N-methyl-2-N-(4-methylpentan-2-yl)-4-N-propyl-1,3,5-triazine-2,4-diamine?
6-methoxy-2-N-methyl-2-N-(4-methylpentan-2-yl)-4-N-propyl-1,3,5-triazine-2,4-diamine has a molecular weight of 281.40 g/mol, XLogP of 2.57, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-2-N-methyl-2-N-(4-methylpentan-2-yl)-4-N-propyl-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 80810740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).