1-N,1-N,2-N,2-N,3-N,3-N-hexamethylcyclopenta-1,3-diene-1,2,3-triamine

C11H21N3 — CID 87388747

IUPAC1-N,1-N,2-N,2-N,3-N,3-N-hexamethylcyclopenta-1,3-diene-1,2,3-triamine
SMILESCN(C)C1=CCC(N(C)C)=C1N(C)C
InChIInChI=1S/C11H21N3/c1-12(2)9-7-8-10(13(3)4)11(9)14(5)6/h7H,8H2,1-6H3
InChIKeyMUZPBPOJZRJWGH-UHFFFAOYSA-N
MW195.31 g/mol
LogP1.17
Rot. Bonds3

About 1-N,1-N,2-N,2-N,3-N,3-N-hexamethylcyclopenta-1,3-diene-1,2,3-triamine

1-N,1-N,2-N,2-N,3-N,3-N-hexamethylcyclopenta-1,3-diene-1,2,3-triamine (PubChem CID 87388747) has the molecular formula C11H21N3 and a molecular weight of 195.31 g/mol. Its IUPAC name is 1-N,1-N,2-N,2-N,3-N,3-N-hexamethylcyclopenta-1,3-diene-1,2,3-triamine.

Molecular Properties

Compound Name1-N,1-N,2-N,2-N,3-N,3-N-hexamethylcyclopenta-1,3-diene-1,2,3-triamine
PubChem CID87388747
Molecular FormulaC11H21N3
Molecular Weight195.31 g/mol
Exact Mass195.17
IUPAC Name1-N,1-N,2-N,2-N,3-N,3-N-hexamethylcyclopenta-1,3-diene-1,2,3-triamine
SMILESCN(C)C1=CCC(N(C)C)=C1N(C)C
InChIInChI=1S/C11H21N3/c1-12(2)9-7-8-10(13(3)4)11(9)14(5)6/h7H,8H2,1-6H3
InChIKeyMUZPBPOJZRJWGH-UHFFFAOYSA-N
XLogP1.17
TPSA9.72 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.31
LogP ≤ 51.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 1-N,1-N,2-N,2-N,3-N,3-N-hexamethylcyclopenta-1,3-diene-1,2,3-triamine with MolForge

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Related Compounds

1-N,1-N,3-N,3-N,2-pentamethylcyclopenta-1,3-diene-1,3-diamine
CID 22996625
1-N,1-N,3-N,3-N-tetramethylcyclopenta-1,3-diene-1,3-diamine
CID 22996630
Methyl-(2-methyl-5-methylazanidylcyclopenta-1,4-dien-1-yl)azanide
CID 58399761
1-N,1-N,2-N,2-N,3-N,3-N-hexamethylcyclopenta-1,3-diene-1,2,3-triamine;zirconium
CID 87388746
N-methyl-6-methylidene-1-[(2E)-penta-2,4-dien-2-yl]-N-propyl-2,3-dihydropyridin-5-amine
CID 117796417
N-methyl-6-methylidene-1-penta-2,4-dien-2-yl-N-propyl-2,3-dihydropyridin-5-amine
CID 123145781
(3Z,5E)-N,N,5,6-tetramethylocta-3,5-dien-4-amine
CID 129112357
(2E)-N,N,4,5-tetramethylhexa-2,4-dien-3-amine
CID 130286090
1-Tert-butyl-5-(1-tert-butyl-2,3-dihydropyrrol-5-yl)-2,3-dihydropyrrole
CID 130334777
N'-[(2Z,4Z)-4,6-dimethylhepta-2,4,6-trien-3-yl]-N,N,N'-trimethylethane-1,2-diamine
CID 139516197
(4E,7Z)-1-N,1-N,5-N,5-N-tetramethylcycloocta-1,2,4,7-tetraene-1,5-diamine
CID 142992167
N,N-dimethyl-2-(5-methyl-2,3-dihydropyrrol-1-yl)ethanamine
CID 143197618

Frequently Asked Questions

What is the IUPAC name of 1-N,1-N,2-N,2-N,3-N,3-N-hexamethylcyclopenta-1,3-diene-1,2,3-triamine?
The IUPAC name of 1-N,1-N,2-N,2-N,3-N,3-N-hexamethylcyclopenta-1,3-diene-1,2,3-triamine (CID 87388747) is 1-N,1-N,2-N,2-N,3-N,3-N-hexamethylcyclopenta-1,3-diene-1,2,3-triamine.
What is the SMILES notation for 1-N,1-N,2-N,2-N,3-N,3-N-hexamethylcyclopenta-1,3-diene-1,2,3-triamine?
The canonical SMILES for 1-N,1-N,2-N,2-N,3-N,3-N-hexamethylcyclopenta-1,3-diene-1,2,3-triamine is CN(C)C1=CCC(N(C)C)=C1N(C)C.
What is the InChIKey of 1-N,1-N,2-N,2-N,3-N,3-N-hexamethylcyclopenta-1,3-diene-1,2,3-triamine?
The InChIKey is MUZPBPOJZRJWGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3/c1-12(2)9-7-8-10(13(3)4)11(9)14(5)6/h7H,8H2,1-6H3.
What are the key properties of 1-N,1-N,2-N,2-N,3-N,3-N-hexamethylcyclopenta-1,3-diene-1,2,3-triamine?
1-N,1-N,2-N,2-N,3-N,3-N-hexamethylcyclopenta-1,3-diene-1,2,3-triamine has a molecular weight of 195.31 g/mol, XLogP of 1.17, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,1-N,2-N,2-N,3-N,3-N-hexamethylcyclopenta-1,3-diene-1,2,3-triamine is sourced from PubChem (CID 87388747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).