N-ethyl-6-methoxy-2-methylhexan-3-amine

C10H23NO — CID 60995450

IUPACN-ethyl-6-methoxy-2-methylhexan-3-amine
SMILESCCNC(CCCOC)C(C)C
InChIInChI=1S/C10H23NO/c1-5-11-10(9(2)3)7-6-8-12-4/h9-11H,5-8H2,1-4H3
InChIKeyOZFGUMLFRMKYKG-UHFFFAOYSA-N
MW173.30 g/mol
LogP2.05
Rot. Bonds7

About N-ethyl-6-methoxy-2-methylhexan-3-amine

N-ethyl-6-methoxy-2-methylhexan-3-amine (PubChem CID 60995450) has the molecular formula C10H23NO and a molecular weight of 173.30 g/mol. Its IUPAC name is N-ethyl-6-methoxy-2-methylhexan-3-amine.

Molecular Properties

Compound NameN-ethyl-6-methoxy-2-methylhexan-3-amine
PubChem CID60995450
Molecular FormulaC10H23NO
Molecular Weight173.30 g/mol
Exact Mass173.18
IUPAC NameN-ethyl-6-methoxy-2-methylhexan-3-amine
SMILESCCNC(CCCOC)C(C)C
InChIInChI=1S/C10H23NO/c1-5-11-10(9(2)3)7-6-8-12-4/h9-11H,5-8H2,1-4H3
InChIKeyOZFGUMLFRMKYKG-UHFFFAOYSA-N
XLogP2.05
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.30
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[(3R)-3-fluorobutan-2-yl]-2-methyl-1-(oxan-4-yl)propan-1-amine
CID 173964280
2-Methyl-4-Methylaminohexanol
CID 76589891
N,2-dimethyl-6-(2,2,2-trifluoroethoxy)hexan-3-amine
CID 61490817
N-ethyl-2-methyl-6-(2,2,2-trifluoroethoxy)hexan-3-amine
CID 61490818
2-methyl-N-propyl-6-(2,2,2-trifluoroethoxy)hexan-3-amine
CID 61490819
4-methyl-N-propan-2-yl-2-[2-(2,2,2-trifluoroethoxy)ethyl]pentan-1-amine
CID 62529713
N-ethyl-4-methyl-6-(2,2,2-trifluoroethoxy)hexan-3-amine
CID 63560784
4-methyl-N-propyl-6-(2,2,2-trifluoroethoxy)hexan-3-amine
CID 63561566
2-methyl-N-propan-2-yl-6-(2,2,2-trifluoroethoxy)hexan-1-amine
CID 64663720
1-(2,2-difluoroethoxy)-N-ethyl-5-methylhexan-3-amine
CID 103149478
1-(2,2-difluoroethoxy)-5-methyl-N-propylhexan-3-amine
CID 103149799
1,1,1-trifluoro-6-methoxy-N,4-dimethyl-2-(trifluoromethyl)hexan-3-amine
CID 103312317

Frequently Asked Questions

What is the IUPAC name of N-ethyl-6-methoxy-2-methylhexan-3-amine?
The IUPAC name of N-ethyl-6-methoxy-2-methylhexan-3-amine (CID 60995450) is N-ethyl-6-methoxy-2-methylhexan-3-amine.
What is the SMILES notation for N-ethyl-6-methoxy-2-methylhexan-3-amine?
The canonical SMILES for N-ethyl-6-methoxy-2-methylhexan-3-amine is CCNC(CCCOC)C(C)C.
What is the InChIKey of N-ethyl-6-methoxy-2-methylhexan-3-amine?
The InChIKey is OZFGUMLFRMKYKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23NO/c1-5-11-10(9(2)3)7-6-8-12-4/h9-11H,5-8H2,1-4H3.
What are the key properties of N-ethyl-6-methoxy-2-methylhexan-3-amine?
N-ethyl-6-methoxy-2-methylhexan-3-amine has a molecular weight of 173.30 g/mol, XLogP of 2.05, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-6-methoxy-2-methylhexan-3-amine is sourced from PubChem (CID 60995450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).