1,4,7-trimethyl-1,4,7-triazecane

C10H23N3 — CID 15461213

IUPAC1,4,7-trimethyl-1,4,7-triazecane
SMILESCN1CCCN(C)CCN(C)CC1
InChIInChI=1S/C10H23N3/c1-11-5-4-6-12(2)8-10-13(3)9-7-11/h4-10H2,1-3H3
InChIKeyDEKIYHATMYCZIN-UHFFFAOYSA-N
MW185.31 g/mol
LogP0.19
Rot. Bonds

About 1,4,7-trimethyl-1,4,7-triazecane

1,4,7-trimethyl-1,4,7-triazecane (PubChem CID 15461213) has the molecular formula C10H23N3 and a molecular weight of 185.31 g/mol. Its IUPAC name is 1,4,7-trimethyl-1,4,7-triazecane.

Molecular Properties

Compound Name1,4,7-trimethyl-1,4,7-triazecane
PubChem CID15461213
Molecular FormulaC10H23N3
Molecular Weight185.31 g/mol
Exact Mass185.19
IUPAC Name1,4,7-trimethyl-1,4,7-triazecane
SMILESCN1CCCN(C)CCN(C)CC1
InChIInChI=1S/C10H23N3/c1-11-5-4-6-12(2)8-10-13(3)9-7-11/h4-10H2,1-3H3
InChIKeyDEKIYHATMYCZIN-UHFFFAOYSA-N
XLogP0.19
TPSA9.72 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 50.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

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bis(1,4-dimethylpiperazine);ethane;tris(1-methylpiperidine)
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copper;1,4,8,11-tetramethyl-1,4,8,11-tetrazacyclotetradecane;diperchlorate
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1,3-dimethyl-1,3-diazetidine;1,3-dimethyl-1,3-diazinane;1,4-dimethylpiperazine;methane
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1-methylpyrrolidine;phosphane
CID 159655297
CID 172772830
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1-methylpiperidine
CID 90254979
1-methylpiperidine
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ethane;bis(1-methylpyrrolidine)
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1,4-dimethylpiperazine;ethane;methane;1-methylpiperidine
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Frequently Asked Questions

What is the IUPAC name of 1,4,7-trimethyl-1,4,7-triazecane?
The IUPAC name of 1,4,7-trimethyl-1,4,7-triazecane (CID 15461213) is 1,4,7-trimethyl-1,4,7-triazecane.
What is the SMILES notation for 1,4,7-trimethyl-1,4,7-triazecane?
The canonical SMILES for 1,4,7-trimethyl-1,4,7-triazecane is CN1CCCN(C)CCN(C)CC1.
What is the InChIKey of 1,4,7-trimethyl-1,4,7-triazecane?
The InChIKey is DEKIYHATMYCZIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23N3/c1-11-5-4-6-12(2)8-10-13(3)9-7-11/h4-10H2,1-3H3.
What are the key properties of 1,4,7-trimethyl-1,4,7-triazecane?
1,4,7-trimethyl-1,4,7-triazecane has a molecular weight of 185.31 g/mol, XLogP of 0.19, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4,7-trimethyl-1,4,7-triazecane is sourced from PubChem (CID 15461213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).