N,2-diethylhexan-1-amine

C10H23N — CID 14272988

IUPACN,2-diethylhexan-1-amine
SMILESCCCCC(CC)CNCC
InChIInChI=1S/C10H23N/c1-4-7-8-10(5-2)9-11-6-3/h10-11H,4-9H2,1-3H3
InChIKeyIQGLRXQADKZNIS-UHFFFAOYSA-N
MW157.30 g/mol
LogP2.81
Rot. Bonds7

About N,2-diethylhexan-1-amine

N,2-diethylhexan-1-amine (PubChem CID 14272988) has the molecular formula C10H23N and a molecular weight of 157.30 g/mol. Its IUPAC name is N,2-diethylhexan-1-amine.

Molecular Properties

Compound NameN,2-diethylhexan-1-amine
PubChem CID14272988
Molecular FormulaC10H23N
Molecular Weight157.30 g/mol
Exact Mass157.18
IUPAC NameN,2-diethylhexan-1-amine
SMILESCCCCC(CC)CNCC
InChIInChI=1S/C10H23N/c1-4-7-8-10(5-2)9-11-6-3/h10-11H,4-9H2,1-3H3
InChIKeyIQGLRXQADKZNIS-UHFFFAOYSA-N
XLogP2.81
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.30
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

magnesium;2-ethyl-N-(2-ethylhexyl)hexan-1-amine;dichloride
CID 174776336
2-ethyl-N-pentylhexan-1-amine
CID 43081963
N,5-diethyl-2,3-dimethylnonan-1-amine
CID 81016450
(2S,4S)-N-[(2S,4S)-2,4-diethyloctyl]-2,4-diethyloctan-1-amine
CID 97464990
(2S,4S)-N-[(2R,4R)-2,4-diethyloctyl]-2,4-diethyloctan-1-amine
CID 97464987
2-ethyl-N-(3-methyl-2-propan-2-ylbutyl)hexan-1-amine
CID 102905339
octakis(dihydroxy(dioxo)molybdenum);2-ethyl-N-(2-ethylhexyl)hexan-1-amine
CID 173007117
dihydroxy(dioxo)molybdenum;2-ethyl-N-(2-ethylhexyl)hexan-1-amine
CID 87301269
N-ethyl-2-propylnonan-1-amine
CID 63498677
N,2-diethyl-5-ethylsulfonylpentan-1-amine
CID 65097608
3-N-(2-ethylhexyl)propane-1,1,3-triamine
CID 142717096
magnesium;N-(2-ethylhexyl)-2-propylheptan-1-amine;dichloride
CID 175293817

Frequently Asked Questions

What is the IUPAC name of N,2-diethylhexan-1-amine?
The IUPAC name of N,2-diethylhexan-1-amine (CID 14272988) is N,2-diethylhexan-1-amine.
What is the SMILES notation for N,2-diethylhexan-1-amine?
The canonical SMILES for N,2-diethylhexan-1-amine is CCCCC(CC)CNCC.
What is the InChIKey of N,2-diethylhexan-1-amine?
The InChIKey is IQGLRXQADKZNIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23N/c1-4-7-8-10(5-2)9-11-6-3/h10-11H,4-9H2,1-3H3.
What are the key properties of N,2-diethylhexan-1-amine?
N,2-diethylhexan-1-amine has a molecular weight of 157.30 g/mol, XLogP of 2.81, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-diethylhexan-1-amine is sourced from PubChem (CID 14272988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).