N-ethyl-5-methoxy-3-methylpentan-2-amine

C9H21NO — CID 60995312

IUPACN-ethyl-5-methoxy-3-methylpentan-2-amine
SMILESCCNC(C)C(C)CCOC
InChIInChI=1S/C9H21NO/c1-5-10-9(3)8(2)6-7-11-4/h8-10H,5-7H2,1-4H3
InChIKeyUITLVGPMYHCYNO-UHFFFAOYSA-N
MW159.27 g/mol
LogP1.66
Rot. Bonds6

About N-ethyl-5-methoxy-3-methylpentan-2-amine

N-ethyl-5-methoxy-3-methylpentan-2-amine (PubChem CID 60995312) has the molecular formula C9H21NO and a molecular weight of 159.27 g/mol. Its IUPAC name is N-ethyl-5-methoxy-3-methylpentan-2-amine.

Molecular Properties

Compound NameN-ethyl-5-methoxy-3-methylpentan-2-amine
PubChem CID60995312
Molecular FormulaC9H21NO
Molecular Weight159.27 g/mol
Exact Mass159.16
IUPAC NameN-ethyl-5-methoxy-3-methylpentan-2-amine
SMILESCCNC(C)C(C)CCOC
InChIInChI=1S/C9H21NO/c1-5-10-9(3)8(2)6-7-11-4/h8-10H,5-7H2,1-4H3
InChIKeyUITLVGPMYHCYNO-UHFFFAOYSA-N
XLogP1.66
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.27
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-5-(3-methoxypropoxy)-3-methylpentan-2-amine
CID 103181104
N-ethyl-6-methoxy-4-methylhexan-3-amine
CID 63561367
(2S,3R)-N-ethyl-3-methylhexan-2-amine
CID 51891368
N-ethyl-1,6-dimethoxy-3,6-dimethylheptan-4-amine
CID 103029407
N-ethyl-1,1,1-trifluoro-6-methoxy-4-methyl-2-(trifluoromethyl)hexan-3-amine
CID 103312319
N-ethyl-6-methoxy-3,6-dimethylheptan-2-amine
CID 103034557
N-(3-methoxypropyl)-3-methylpentan-2-amine
CID 43205167
1-(4-tert-butylphenyl)-N-ethyl-4-methoxy-2-methylbutan-1-amine
CID 105044758
N-ethyl-3-methyloct-6-yn-2-amine
CID 104811014
1-(3,4-dimethylphenyl)-N-ethyl-4-methoxy-2-methylbutan-1-amine
CID 105044614
N-ethyl-4-methoxy-2-methyl-1-[4-(trifluoromethyl)cyclohexyl]butan-1-amine
CID 105185029
N-ethyl-4-methoxy-2-methyl-1-[4-(trifluoromethyl)phenyl]butan-1-amine
CID 105044213

Frequently Asked Questions

What is the IUPAC name of N-ethyl-5-methoxy-3-methylpentan-2-amine?
The IUPAC name of N-ethyl-5-methoxy-3-methylpentan-2-amine (CID 60995312) is N-ethyl-5-methoxy-3-methylpentan-2-amine.
What is the SMILES notation for N-ethyl-5-methoxy-3-methylpentan-2-amine?
The canonical SMILES for N-ethyl-5-methoxy-3-methylpentan-2-amine is CCNC(C)C(C)CCOC.
What is the InChIKey of N-ethyl-5-methoxy-3-methylpentan-2-amine?
The InChIKey is UITLVGPMYHCYNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21NO/c1-5-10-9(3)8(2)6-7-11-4/h8-10H,5-7H2,1-4H3.
What are the key properties of N-ethyl-5-methoxy-3-methylpentan-2-amine?
N-ethyl-5-methoxy-3-methylpentan-2-amine has a molecular weight of 159.27 g/mol, XLogP of 1.66, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-5-methoxy-3-methylpentan-2-amine is sourced from PubChem (CID 60995312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).