6-ethyl-4-methyldecan-3-amine

C13H29N — CID 63562264

IUPAC6-ethyl-4-methyldecan-3-amine
SMILESCCCCC(CC)CC(C)C(N)CC
InChIInChI=1S/C13H29N/c1-5-8-9-12(6-2)10-11(4)13(14)7-3/h11-13H,5-10,14H2,1-4H3
InChIKeySDBDUTYJRQMQOD-UHFFFAOYSA-N
MW199.38 g/mol
LogP3.97
Rot. Bonds8

About 6-ethyl-4-methyldecan-3-amine

6-ethyl-4-methyldecan-3-amine (PubChem CID 63562264) has the molecular formula C13H29N and a molecular weight of 199.38 g/mol. Its IUPAC name is 6-ethyl-4-methyldecan-3-amine.

Molecular Properties

Compound Name6-ethyl-4-methyldecan-3-amine
PubChem CID63562264
Molecular FormulaC13H29N
Molecular Weight199.38 g/mol
Exact Mass199.23
IUPAC Name6-ethyl-4-methyldecan-3-amine
SMILESCCCCC(CC)CC(C)C(N)CC
InChIInChI=1S/C13H29N/c1-5-8-9-12(6-2)10-11(4)13(14)7-3/h11-13H,5-10,14H2,1-4H3
InChIKeySDBDUTYJRQMQOD-UHFFFAOYSA-N
XLogP3.97
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.38
LogP ≤ 53.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

7-ethyl-3-methylundecan-5-amine
CID 115806452
(5S)-3,5-diethylnonane;methane
CID 159387669
N,5-diethyl-2,3-dimethylnonan-1-amine
CID 81016450
2,4-dimethylnonan-5-amine
CID 123957338
(2R,4S)-4-ethyloctan-2-ol
CID 7015159
5,9-diethyl-7-(2-methylpropyl)tridecane
CID 173141748
4-methylundecan-3-amine
CID 63562083
6-ethyl-4-methyldecane
CID 22224210
4-ethyloctan-2-ylhydrazine
CID 105201240
5-butyl-2,3-dimethylnonane
CID 123894711
5,9-diethyl-7-(2-ethylpentyl)tridecane
CID 170533070
4,5,7-triethylundecane
CID 123222302

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-4-methyldecan-3-amine?
The IUPAC name of 6-ethyl-4-methyldecan-3-amine (CID 63562264) is 6-ethyl-4-methyldecan-3-amine.
What is the SMILES notation for 6-ethyl-4-methyldecan-3-amine?
The canonical SMILES for 6-ethyl-4-methyldecan-3-amine is CCCCC(CC)CC(C)C(N)CC.
What is the InChIKey of 6-ethyl-4-methyldecan-3-amine?
The InChIKey is SDBDUTYJRQMQOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H29N/c1-5-8-9-12(6-2)10-11(4)13(14)7-3/h11-13H,5-10,14H2,1-4H3.
What are the key properties of 6-ethyl-4-methyldecan-3-amine?
6-ethyl-4-methyldecan-3-amine has a molecular weight of 199.38 g/mol, XLogP of 3.97, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-4-methyldecan-3-amine is sourced from PubChem (CID 63562264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).