N-ethyl-N,2-dimethylhexan-3-amine

C10H23N — CID 18689296

IUPACN-ethyl-N,2-dimethylhexan-3-amine
SMILESCCCC(C(C)C)N(C)CC
InChIInChI=1S/C10H23N/c1-6-8-10(9(3)4)11(5)7-2/h9-10H,6-8H2,1-5H3
InChIKeyFSUYNHDFGZVELK-UHFFFAOYSA-N
MW157.30 g/mol
LogP2.76
Rot. Bonds5

About N-ethyl-N,2-dimethylhexan-3-amine

N-ethyl-N,2-dimethylhexan-3-amine (PubChem CID 18689296) has the molecular formula C10H23N and a molecular weight of 157.30 g/mol. Its IUPAC name is N-ethyl-N,2-dimethylhexan-3-amine.

Molecular Properties

Compound NameN-ethyl-N,2-dimethylhexan-3-amine
PubChem CID18689296
Molecular FormulaC10H23N
Molecular Weight157.30 g/mol
Exact Mass157.18
IUPAC NameN-ethyl-N,2-dimethylhexan-3-amine
SMILESCCCC(C(C)C)N(C)CC
InChIInChI=1S/C10H23N/c1-6-8-10(9(3)4)11(5)7-2/h9-10H,6-8H2,1-5H3
InChIKeyFSUYNHDFGZVELK-UHFFFAOYSA-N
XLogP2.76
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.30
LogP ≤ 52.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-isopropyl-N,N,2,-trimethylpropylamine
CID 6453029
1,2,5-Trimethylpiperidine
CID 338922
Piperidine, 1,2,4-trimethyl-
CID 21627804
(2S,4S)-1,2,4-trimethylpiperidine
CID 21627805
N-Methyl-N-(4-methylheptan-2-yl)cyclopropanamine
CID 27526
N-Methyl-N-(6-methylheptan-2-yl)cyclopropanamine
CID 27734
Diethyl-(2-methyl-hexyl)-amine
CID 21965431
N-(Cyclohexylmethyl)-N-(propan-2-yl)propan-2-amine
CID 12865551
1,2,4-Trimethylpiperidine
CID 14454419
N,N,2-trimethylhexan-1-amine
CID 21966039
N-(1-Isopropyl-2-methylpropyl)diisobutylamine
CID 3016892
(2S,3R)-1,2,3-trimethylpiperidine
CID 642610

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N,2-dimethylhexan-3-amine?
The IUPAC name of N-ethyl-N,2-dimethylhexan-3-amine (CID 18689296) is N-ethyl-N,2-dimethylhexan-3-amine.
What is the SMILES notation for N-ethyl-N,2-dimethylhexan-3-amine?
The canonical SMILES for N-ethyl-N,2-dimethylhexan-3-amine is CCCC(C(C)C)N(C)CC.
What is the InChIKey of N-ethyl-N,2-dimethylhexan-3-amine?
The InChIKey is FSUYNHDFGZVELK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23N/c1-6-8-10(9(3)4)11(5)7-2/h9-10H,6-8H2,1-5H3.
What are the key properties of N-ethyl-N,2-dimethylhexan-3-amine?
N-ethyl-N,2-dimethylhexan-3-amine has a molecular weight of 157.30 g/mol, XLogP of 2.76, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N,2-dimethylhexan-3-amine is sourced from PubChem (CID 18689296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).