4-N-(2,3-dimethylcyclopentyl)-2-N,2-N-diethyl-1,3,5-triazine-2,4,6-triamine

C14H26N6 — CID 80841384

IUPAC4-N-(2,3-dimethylcyclopentyl)-2-N,2-N-diethyl-1,3,5-triazine-2,4,6-triamine
SMILESCCN(CC)c1nc(N)nc(NC2CCC(C)C2C)n1
InChIInChI=1S/C14H26N6/c1-5-20(6-2)14-18-12(15)17-13(19-14)16-11-8-7-9(3)10(11)4/h9-11H,5-8H2,1-4H3,(H3,15,16,17,18,19)
InChIKeyXPPWDHRHAGCZJL-UHFFFAOYSA-N
MW278.40 g/mol
LogP2.15
Rot. Bonds5

About 4-N-(2,3-dimethylcyclopentyl)-2-N,2-N-diethyl-1,3,5-triazine-2,4,6-triamine

4-N-(2,3-dimethylcyclopentyl)-2-N,2-N-diethyl-1,3,5-triazine-2,4,6-triamine (PubChem CID 80841384) has the molecular formula C14H26N6 and a molecular weight of 278.40 g/mol. Its IUPAC name is 4-N-(2,3-dimethylcyclopentyl)-2-N,2-N-diethyl-1,3,5-triazine-2,4,6-triamine.

Molecular Properties

Compound Name4-N-(2,3-dimethylcyclopentyl)-2-N,2-N-diethyl-1,3,5-triazine-2,4,6-triamine
PubChem CID80841384
Molecular FormulaC14H26N6
Molecular Weight278.40 g/mol
Exact Mass278.22
IUPAC Name4-N-(2,3-dimethylcyclopentyl)-2-N,2-N-diethyl-1,3,5-triazine-2,4,6-triamine
SMILESCCN(CC)c1nc(N)nc(NC2CCC(C)C2C)n1
InChIInChI=1S/C14H26N6/c1-5-20(6-2)14-18-12(15)17-13(19-14)16-11-8-7-9(3)10(11)4/h9-11H,5-8H2,1-4H3,(H3,15,16,17,18,19)
InChIKeyXPPWDHRHAGCZJL-UHFFFAOYSA-N
XLogP2.15
TPSA79.96 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 52.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 4-N-(2,3-dimethylcyclopentyl)-2-N,2-N-diethyl-1,3,5-triazine-2,4,6-triamine with MolForge

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Launch Full Analysis

Related Compounds

4-N-(2,3-dimethylcyclohexyl)-2-N,2-N-diethyl-1,3,5-triazine-2,4,6-triamine
CID 80772477
2-N-(2,3-dimethylcyclopentyl)-4-N,4-N-diethyl-6-hydrazinyl-1,3,5-triazine-2,4-diamine
CID 80909767
2-N,2-N-diethyl-4-N-(2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl)-1,3,5-triazine-2,4,6-triamine
CID 80785173
2-N,2-N-diethyl-4-N-(1-methylpyrrolidin-3-yl)-1,3,5-triazine-2,4,6-triamine
CID 80802963
4-N,4-N-diethyl-6-hydrazinyl-2-N-(2-methylcyclohexyl)-1,3,5-triazine-2,4-diamine
CID 80938212
4-N-(2,2-dimethyloxan-4-yl)-2-N,2-N-diethyl-1,3,5-triazine-2,4,6-triamine
CID 83036316
2-N-(cyclopropylmethyl)-2-N,4-N,4-N-triethyl-1,3,5-triazine-2,4,6-triamine
CID 80839965
2-N,2-N-diethyl-4-N-propyl-1,3,5-triazine-2,4,6-triamine
CID 80765267
2-N-cyclopropyl-2-N,4-N,4-N-triethyl-1,3,5-triazine-2,4,6-triamine
CID 80773987
2-N-(2,3-dimethylcyclohexyl)-6-ethoxy-1,3,5-triazine-2,4-diamine
CID 80777218
2-N-(2,3-dimethylcyclopentyl)-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine
CID 80826348
6-chloro-2-N,2-N-diethyl-4-N-(2-methylcyclohexyl)-1,3,5-triazine-2,4-diamine
CID 62870396

Frequently Asked Questions

What is the IUPAC name of 4-N-(2,3-dimethylcyclopentyl)-2-N,2-N-diethyl-1,3,5-triazine-2,4,6-triamine?
The IUPAC name of 4-N-(2,3-dimethylcyclopentyl)-2-N,2-N-diethyl-1,3,5-triazine-2,4,6-triamine (CID 80841384) is 4-N-(2,3-dimethylcyclopentyl)-2-N,2-N-diethyl-1,3,5-triazine-2,4,6-triamine.
What is the SMILES notation for 4-N-(2,3-dimethylcyclopentyl)-2-N,2-N-diethyl-1,3,5-triazine-2,4,6-triamine?
The canonical SMILES for 4-N-(2,3-dimethylcyclopentyl)-2-N,2-N-diethyl-1,3,5-triazine-2,4,6-triamine is CCN(CC)c1nc(N)nc(NC2CCC(C)C2C)n1.
What is the InChIKey of 4-N-(2,3-dimethylcyclopentyl)-2-N,2-N-diethyl-1,3,5-triazine-2,4,6-triamine?
The InChIKey is XPPWDHRHAGCZJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N6/c1-5-20(6-2)14-18-12(15)17-13(19-14)16-11-8-7-9(3)10(11)4/h9-11H,5-8H2,1-4H3,(H3,15,16,17,18,19).
What are the key properties of 4-N-(2,3-dimethylcyclopentyl)-2-N,2-N-diethyl-1,3,5-triazine-2,4,6-triamine?
4-N-(2,3-dimethylcyclopentyl)-2-N,2-N-diethyl-1,3,5-triazine-2,4,6-triamine has a molecular weight of 278.40 g/mol, XLogP of 2.15, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-(2,3-dimethylcyclopentyl)-2-N,2-N-diethyl-1,3,5-triazine-2,4,6-triamine is sourced from PubChem (CID 80841384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).