4-ethyl-N,N,2,4-tetramethylhexan-2-amine

C12H27N — CID 134476921

IUPAC4-ethyl-N,N,2,4-tetramethylhexan-2-amine
SMILESCCC(C)(CC)CC(C)(C)N(C)C
InChIInChI=1S/C12H27N/c1-8-12(5,9-2)10-11(3,4)13(6)7/h8-10H2,1-7H3
InChIKeyQQKMASMYNDGFQD-UHFFFAOYSA-N
MW185.35 g/mol
LogP3.54
Rot. Bonds5

About 4-ethyl-N,N,2,4-tetramethylhexan-2-amine

4-ethyl-N,N,2,4-tetramethylhexan-2-amine (PubChem CID 134476921) has the molecular formula C12H27N and a molecular weight of 185.35 g/mol. Its IUPAC name is 4-ethyl-N,N,2,4-tetramethylhexan-2-amine.

Molecular Properties

Compound Name4-ethyl-N,N,2,4-tetramethylhexan-2-amine
PubChem CID134476921
Molecular FormulaC12H27N
Molecular Weight185.35 g/mol
Exact Mass185.21
IUPAC Name4-ethyl-N,N,2,4-tetramethylhexan-2-amine
SMILESCCC(C)(CC)CC(C)(C)N(C)C
InChIInChI=1S/C12H27N/c1-8-12(5,9-2)10-11(3,4)13(6)7/h8-10H2,1-7H3
InChIKeyQQKMASMYNDGFQD-UHFFFAOYSA-N
XLogP3.54
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.35
LogP ≤ 53.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

4-(dimethylamino)-2-ethyl-N,N,2,4-tetramethylpentanamide
CID 90739984
ethane;3-ethyl-3-methylpentane
CID 158904304
2-tert-butyl-4-ethyl-N,N,2,4-tetramethylhexanamide
CID 142377248
4-ethyl-1,1,1-trifluoro-2,2,4-trimethylhexane
CID 137409312
3-ethyl-3-methylpentane;methanol
CID 143799596
5-(dimethylamino)-3,3,5-trimethylhexanoic acid
CID 123179044
(2R)-2-(dimethylamino)butane-2-thiol
CID 160975847
N-iodo-N,2-dimethylbutan-2-amine
CID 154548440
4-(aminomethyl)-2,4-dimethylhexan-2-ol
CID 89363832
2-[(dimethylamino)methyl]-2-methylbutan-1-ol
CID 62270560
N,4-diethyl-N,2,4-trimethylhexan-1-amine
CID 123611396
N-[4-(dimethylamino)-2,4-dimethylpentan-2-yl]methanesulfonamide
CID 89331793

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N,N,2,4-tetramethylhexan-2-amine?
The IUPAC name of 4-ethyl-N,N,2,4-tetramethylhexan-2-amine (CID 134476921) is 4-ethyl-N,N,2,4-tetramethylhexan-2-amine.
What is the SMILES notation for 4-ethyl-N,N,2,4-tetramethylhexan-2-amine?
The canonical SMILES for 4-ethyl-N,N,2,4-tetramethylhexan-2-amine is CCC(C)(CC)CC(C)(C)N(C)C.
What is the InChIKey of 4-ethyl-N,N,2,4-tetramethylhexan-2-amine?
The InChIKey is QQKMASMYNDGFQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H27N/c1-8-12(5,9-2)10-11(3,4)13(6)7/h8-10H2,1-7H3.
What are the key properties of 4-ethyl-N,N,2,4-tetramethylhexan-2-amine?
4-ethyl-N,N,2,4-tetramethylhexan-2-amine has a molecular weight of 185.35 g/mol, XLogP of 3.54, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N,N,2,4-tetramethylhexan-2-amine is sourced from PubChem (CID 134476921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).