N,N-diethyl-2-(methoxymethyl)-2-propan-2-ylpentan-1-amine

C14H31NO — CID 139968834

IUPACN,N-diethyl-2-(methoxymethyl)-2-propan-2-ylpentan-1-amine
SMILESCCCC(COC)(CN(CC)CC)C(C)C
InChIInChI=1S/C14H31NO/c1-7-10-14(12-16-6,13(4)5)11-15(8-2)9-3/h13H,7-12H2,1-6H3
InChIKeyWYHSFGMRJOJUPB-UHFFFAOYSA-N
MW229.41 g/mol
LogP3.42
Rot. Bonds9

About N,N-diethyl-2-(methoxymethyl)-2-propan-2-ylpentan-1-amine

N,N-diethyl-2-(methoxymethyl)-2-propan-2-ylpentan-1-amine (PubChem CID 139968834) has the molecular formula C14H31NO and a molecular weight of 229.41 g/mol. Its IUPAC name is N,N-diethyl-2-(methoxymethyl)-2-propan-2-ylpentan-1-amine.

Molecular Properties

Compound NameN,N-diethyl-2-(methoxymethyl)-2-propan-2-ylpentan-1-amine
PubChem CID139968834
Molecular FormulaC14H31NO
Molecular Weight229.41 g/mol
Exact Mass229.24
IUPAC NameN,N-diethyl-2-(methoxymethyl)-2-propan-2-ylpentan-1-amine
SMILESCCCC(COC)(CN(CC)CC)C(C)C
InChIInChI=1S/C14H31NO/c1-7-10-14(12-16-6,13(4)5)11-15(8-2)9-3/h13H,7-12H2,1-6H3
InChIKeyWYHSFGMRJOJUPB-UHFFFAOYSA-N
XLogP3.42
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.41
LogP ≤ 53.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

6-Tert-butyl-5-propan-2-yl-3-propyl-1,3-oxazinane
CID 59996868
5,6-Ditert-butyl-3-propyl-1,3-oxazinane
CID 59996916
2-(Methoxymethyl)-N,N,3-trimethyl-2-(propan-2-yl)butan-1-amine
CID 71350379
2-(Methoxymethyl)-N,N-dimethyl-2-propylpentan-1-amine
CID 71361648
2-(methoxymethyl)-N,N,4-trimethyl-2-(2-methylpropyl)pentan-1-amine
CID 85863745
N-[(3,5-dimethyl-4-propyloxolan-3-yl)methyl]-N-methylethanamine
CID 91341638
(4S)-4-tert-butyl-1-(3-methoxypropyl)azepane
CID 96496347
(4S)-4-ethyl-6-methoxy-N,N-dimethylhexan-1-amine
CID 118889904
(4S)-N,N,4-triethyl-6-methoxyhexan-1-amine
CID 118889996
(4R)-4-ethyl-6-methoxy-N,N-dimethylhexan-1-amine
CID 118890168
(4R)-N,N,4-triethyl-6-methoxyhexan-1-amine
CID 118890176
N,N-diethyl-5-(methoxymethyl)heptan-1-amine
CID 123201774

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-(methoxymethyl)-2-propan-2-ylpentan-1-amine?
The IUPAC name of N,N-diethyl-2-(methoxymethyl)-2-propan-2-ylpentan-1-amine (CID 139968834) is N,N-diethyl-2-(methoxymethyl)-2-propan-2-ylpentan-1-amine.
What is the SMILES notation for N,N-diethyl-2-(methoxymethyl)-2-propan-2-ylpentan-1-amine?
The canonical SMILES for N,N-diethyl-2-(methoxymethyl)-2-propan-2-ylpentan-1-amine is CCCC(COC)(CN(CC)CC)C(C)C.
What is the InChIKey of N,N-diethyl-2-(methoxymethyl)-2-propan-2-ylpentan-1-amine?
The InChIKey is WYHSFGMRJOJUPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H31NO/c1-7-10-14(12-16-6,13(4)5)11-15(8-2)9-3/h13H,7-12H2,1-6H3.
What are the key properties of N,N-diethyl-2-(methoxymethyl)-2-propan-2-ylpentan-1-amine?
N,N-diethyl-2-(methoxymethyl)-2-propan-2-ylpentan-1-amine has a molecular weight of 229.41 g/mol, XLogP of 3.42, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-(methoxymethyl)-2-propan-2-ylpentan-1-amine is sourced from PubChem (CID 139968834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).