2-N,2-N-dimethyl-4-N-[(3-methylcyclopentyl)methyl]-6-N-propyl-1,3,5-triazine-2,4,6-triamine

C15H28N6 — CID 107415912

IUPAC2-N,2-N-dimethyl-4-N-[(3-methylcyclopentyl)methyl]-6-N-propyl-1,3,5-triazine-2,4,6-triamine
SMILESCCCNc1nc(NCC2CCC(C)C2)nc(N(C)C)n1
InChIInChI=1S/C15H28N6/c1-5-8-16-13-18-14(20-15(19-13)21(3)4)17-10-12-7-6-11(2)9-12/h11-12H,5-10H2,1-4H3,(H2,16,17,18,19,20)
InChIKeyGTJBBUBNBRUBSO-UHFFFAOYSA-N
MW292.43 g/mol
LogP2.61
Rot. Bonds7

About 2-N,2-N-dimethyl-4-N-[(3-methylcyclopentyl)methyl]-6-N-propyl-1,3,5-triazine-2,4,6-triamine

2-N,2-N-dimethyl-4-N-[(3-methylcyclopentyl)methyl]-6-N-propyl-1,3,5-triazine-2,4,6-triamine (PubChem CID 107415912) has the molecular formula C15H28N6 and a molecular weight of 292.43 g/mol. Its IUPAC name is 2-N,2-N-dimethyl-4-N-[(3-methylcyclopentyl)methyl]-6-N-propyl-1,3,5-triazine-2,4,6-triamine.

Molecular Properties

Compound Name2-N,2-N-dimethyl-4-N-[(3-methylcyclopentyl)methyl]-6-N-propyl-1,3,5-triazine-2,4,6-triamine
PubChem CID107415912
Molecular FormulaC15H28N6
Molecular Weight292.43 g/mol
Exact Mass292.24
IUPAC Name2-N,2-N-dimethyl-4-N-[(3-methylcyclopentyl)methyl]-6-N-propyl-1,3,5-triazine-2,4,6-triamine
SMILESCCCNc1nc(NCC2CCC(C)C2)nc(N(C)C)n1
InChIInChI=1S/C15H28N6/c1-5-8-16-13-18-14(20-15(19-13)21(3)4)17-10-12-7-6-11(2)9-12/h11-12H,5-10H2,1-4H3,(H2,16,17,18,19,20)
InChIKeyGTJBBUBNBRUBSO-UHFFFAOYSA-N
XLogP2.61
TPSA65.97 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.43
LogP ≤ 52.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 2-N,2-N-dimethyl-4-N-[(3-methylcyclopentyl)methyl]-6-N-propyl-1,3,5-triazine-2,4,6-triamine with MolForge

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Launch Full Analysis

Related Compounds

3-[[[4-(dimethylamino)-6-(propylamino)-1,3,5-triazin-2-yl]amino]methyl]cyclopentan-1-ol
CID 106138050
5-[[[4-(dimethylamino)-6-(propylamino)-1,3,5-triazin-2-yl]amino]methyl]pyrrolidin-2-one
CID 80823542
4-N-cyclohexyl-2-N,2-N-dimethyl-6-N-propyl-1,3,5-triazine-2,4,6-triamine
CID 80766155
2-[[4-(dimethylamino)-6-(propylamino)-1,3,5-triazin-2-yl]amino]ethanol
CID 80765149
2-N,2-N-dimethyl-6-N-propyl-4-N-(thiolan-3-yl)-1,3,5-triazine-2,4,6-triamine
CID 103065188
4-N-(2,2-dimethylpropyl)-2-N,2-N-dimethyl-6-N-propyl-1,3,5-triazine-2,4,6-triamine
CID 80797913
[2-[[4-(dimethylamino)-6-(propylamino)-1,3,5-triazin-2-yl]amino]cyclopentyl]methanol
CID 106368088
2-N,2-N-dimethyl-4-N-(2-methylpropyl)-6-N-propyl-1,3,5-triazine-2,4,6-triamine
CID 80770907
2-N,2-N-dimethyl-6-N-propyl-4-N-prop-2-ynyl-1,3,5-triazine-2,4,6-triamine
CID 90159200
2-N-cyclopentyl-2-N-ethyl-4-N,4-N-dimethyl-6-N-propyl-1,3,5-triazine-2,4,6-triamine
CID 80774985
2-N-(cyclopropylmethoxy)-2-N-methyl-4-N,6-N-dipropyl-1,3,5-triazine-2,4,6-triamine;sulfuric acid
CID 86665988
6-methyl-4-N-[(4-methylcyclohexyl)methyl]-2-N-propylpyrimidine-2,4-diamine
CID 80827768

Frequently Asked Questions

What is the IUPAC name of 2-N,2-N-dimethyl-4-N-[(3-methylcyclopentyl)methyl]-6-N-propyl-1,3,5-triazine-2,4,6-triamine?
The IUPAC name of 2-N,2-N-dimethyl-4-N-[(3-methylcyclopentyl)methyl]-6-N-propyl-1,3,5-triazine-2,4,6-triamine (CID 107415912) is 2-N,2-N-dimethyl-4-N-[(3-methylcyclopentyl)methyl]-6-N-propyl-1,3,5-triazine-2,4,6-triamine.
What is the SMILES notation for 2-N,2-N-dimethyl-4-N-[(3-methylcyclopentyl)methyl]-6-N-propyl-1,3,5-triazine-2,4,6-triamine?
The canonical SMILES for 2-N,2-N-dimethyl-4-N-[(3-methylcyclopentyl)methyl]-6-N-propyl-1,3,5-triazine-2,4,6-triamine is CCCNc1nc(NCC2CCC(C)C2)nc(N(C)C)n1.
What is the InChIKey of 2-N,2-N-dimethyl-4-N-[(3-methylcyclopentyl)methyl]-6-N-propyl-1,3,5-triazine-2,4,6-triamine?
The InChIKey is GTJBBUBNBRUBSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N6/c1-5-8-16-13-18-14(20-15(19-13)21(3)4)17-10-12-7-6-11(2)9-12/h11-12H,5-10H2,1-4H3,(H2,16,17,18,19,20).
What are the key properties of 2-N,2-N-dimethyl-4-N-[(3-methylcyclopentyl)methyl]-6-N-propyl-1,3,5-triazine-2,4,6-triamine?
2-N,2-N-dimethyl-4-N-[(3-methylcyclopentyl)methyl]-6-N-propyl-1,3,5-triazine-2,4,6-triamine has a molecular weight of 292.43 g/mol, XLogP of 2.61, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,2-N-dimethyl-4-N-[(3-methylcyclopentyl)methyl]-6-N-propyl-1,3,5-triazine-2,4,6-triamine is sourced from PubChem (CID 107415912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).