2-N,2-N,3-N,2-tetramethyl-6-(oxolan-2-yl)hexane-2,3-diamine

C14H30N2O — CID 79054003

IUPAC2-N,2-N,3-N,2-tetramethyl-6-(oxolan-2-yl)hexane-2,3-diamine
SMILESCNC(CCCC1CCCO1)C(C)(C)N(C)C
InChIInChI=1S/C14H30N2O/c1-14(2,16(4)5)13(15-3)10-6-8-12-9-7-11-17-12/h12-13,15H,6-11H2,1-5H3
InChIKeyAKFXQTWFWHOKLQ-UHFFFAOYSA-N
MW242.41 g/mol
LogP2.26
Rot. Bonds7

About 2-N,2-N,3-N,2-tetramethyl-6-(oxolan-2-yl)hexane-2,3-diamine

2-N,2-N,3-N,2-tetramethyl-6-(oxolan-2-yl)hexane-2,3-diamine (PubChem CID 79054003) has the molecular formula C14H30N2O and a molecular weight of 242.41 g/mol. Its IUPAC name is 2-N,2-N,3-N,2-tetramethyl-6-(oxolan-2-yl)hexane-2,3-diamine.

Molecular Properties

Compound Name2-N,2-N,3-N,2-tetramethyl-6-(oxolan-2-yl)hexane-2,3-diamine
PubChem CID79054003
Molecular FormulaC14H30N2O
Molecular Weight242.41 g/mol
Exact Mass242.24
IUPAC Name2-N,2-N,3-N,2-tetramethyl-6-(oxolan-2-yl)hexane-2,3-diamine
SMILESCNC(CCCC1CCCO1)C(C)(C)N(C)C
InChIInChI=1S/C14H30N2O/c1-14(2,16(4)5)13(15-3)10-6-8-12-9-7-11-17-12/h12-13,15H,6-11H2,1-5H3
InChIKeyAKFXQTWFWHOKLQ-UHFFFAOYSA-N
XLogP2.26
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.41
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(dimethylamino)-4-methyl-1-(oxolan-2-yl)pentan-3-ol
CID 79047027
4-N,4-N-diethyl-3-N,4-dimethyl-1-(oxolan-2-yl)hexane-3,4-diamine
CID 79069373
1-cyclobutyl-N-methyl-4-(oxolan-2-yl)butan-1-amine
CID 65164623
N,5,6-trimethyl-1-(oxolan-2-yl)heptan-4-amine
CID 104993166
N,5-dimethyl-1-(oxolan-2-yl)heptan-4-amine
CID 65164663
2-[4-(bromomethyl)-5,5-dimethylhexyl]oxolane
CID 83141397
1,1-diethoxy-N-methyl-5-(oxolan-2-yl)pentan-2-amine
CID 79496181
N-tert-butyl-3-methyl-6-(oxolan-2-yl)hexan-1-amine
CID 81020024
1,1,1-trifluoro-N-methyl-5-(oxolan-2-yl)pentan-3-amine
CID 65164288
N-methyl-4-(oxolan-2-yl)-1-(oxolan-3-yl)butan-1-amine
CID 65330358
2-[4-[5-(oxolan-2-yl)pentan-2-ylsulfanyl]pentyl]oxolane
CID 54448834
5-ethyl-N-methyl-1-(oxolan-2-yl)nonan-4-amine
CID 104993154

Frequently Asked Questions

What is the IUPAC name of 2-N,2-N,3-N,2-tetramethyl-6-(oxolan-2-yl)hexane-2,3-diamine?
The IUPAC name of 2-N,2-N,3-N,2-tetramethyl-6-(oxolan-2-yl)hexane-2,3-diamine (CID 79054003) is 2-N,2-N,3-N,2-tetramethyl-6-(oxolan-2-yl)hexane-2,3-diamine.
What is the SMILES notation for 2-N,2-N,3-N,2-tetramethyl-6-(oxolan-2-yl)hexane-2,3-diamine?
The canonical SMILES for 2-N,2-N,3-N,2-tetramethyl-6-(oxolan-2-yl)hexane-2,3-diamine is CNC(CCCC1CCCO1)C(C)(C)N(C)C.
What is the InChIKey of 2-N,2-N,3-N,2-tetramethyl-6-(oxolan-2-yl)hexane-2,3-diamine?
The InChIKey is AKFXQTWFWHOKLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O/c1-14(2,16(4)5)13(15-3)10-6-8-12-9-7-11-17-12/h12-13,15H,6-11H2,1-5H3.
What are the key properties of 2-N,2-N,3-N,2-tetramethyl-6-(oxolan-2-yl)hexane-2,3-diamine?
2-N,2-N,3-N,2-tetramethyl-6-(oxolan-2-yl)hexane-2,3-diamine has a molecular weight of 242.41 g/mol, XLogP of 2.26, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,2-N,3-N,2-tetramethyl-6-(oxolan-2-yl)hexane-2,3-diamine is sourced from PubChem (CID 79054003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).