N-[3-methoxy-2-(2-methylpentoxy)propyl]-2-methylpropan-2-amine

C14H31NO2 — CID 103285718

IUPACN-[3-methoxy-2-(2-methylpentoxy)propyl]-2-methylpropan-2-amine
SMILESCCCC(C)COC(CNC(C)(C)C)COC
InChIInChI=1S/C14H31NO2/c1-7-8-12(2)10-17-13(11-16-6)9-15-14(3,4)5/h12-13,15H,7-11H2,1-6H3
InChIKeyMTPGGCJMLPQRSA-UHFFFAOYSA-N
MW245.41 g/mol
LogP2.84
Rot. Bonds9

About N-[3-methoxy-2-(2-methylpentoxy)propyl]-2-methylpropan-2-amine

N-[3-methoxy-2-(2-methylpentoxy)propyl]-2-methylpropan-2-amine (PubChem CID 103285718) has the molecular formula C14H31NO2 and a molecular weight of 245.41 g/mol. Its IUPAC name is N-[3-methoxy-2-(2-methylpentoxy)propyl]-2-methylpropan-2-amine.

Molecular Properties

Compound NameN-[3-methoxy-2-(2-methylpentoxy)propyl]-2-methylpropan-2-amine
PubChem CID103285718
Molecular FormulaC14H31NO2
Molecular Weight245.41 g/mol
Exact Mass245.24
IUPAC NameN-[3-methoxy-2-(2-methylpentoxy)propyl]-2-methylpropan-2-amine
SMILESCCCC(C)COC(CNC(C)(C)C)COC
InChIInChI=1S/C14H31NO2/c1-7-8-12(2)10-17-13(11-16-6)9-15-14(3,4)5/h12-13,15H,7-11H2,1-6H3
InChIKeyMTPGGCJMLPQRSA-UHFFFAOYSA-N
XLogP2.84
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.41
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-ethoxy-3-methoxypropyl)-2-methylpropan-2-amine
CID 103227770
N-tert-butyl-2-(1-methoxypropan-2-yloxy)pentan-1-amine
CID 83044032
N-tert-butyl-2-methylpentan-1-amine
CID 43200440
N-[2-[2-[di(propan-2-yl)amino]ethoxy]-3-methoxypropyl]-2-methylpropan-2-amine
CID 103228941
N-tert-butyl-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]pentan-1-amine
CID 104566629
N-tert-butyl-2-methyl-3-octan-2-yloxypropan-1-amine
CID 103074508
N-tert-butyl-2-(2-ethylhexoxy)butan-1-amine
CID 63492820
2-(2-methylpentoxy)-N-propylbutan-1-amine
CID 103285571
N-(1-methoxy-2-methylpropan-2-yl)-2-methylpentan-1-amine
CID 115906085
1-methoxy-2,10,24-trimethylheptacosane
CID 86172880
N-[2-(2-methoxyethoxy)propyl]-2-methylpropan-2-amine
CID 62457300
N-tert-butyl-2-methyl-3-(2-propoxyethoxy)propan-1-amine
CID 103074770

Frequently Asked Questions

What is the IUPAC name of N-[3-methoxy-2-(2-methylpentoxy)propyl]-2-methylpropan-2-amine?
The IUPAC name of N-[3-methoxy-2-(2-methylpentoxy)propyl]-2-methylpropan-2-amine (CID 103285718) is N-[3-methoxy-2-(2-methylpentoxy)propyl]-2-methylpropan-2-amine.
What is the SMILES notation for N-[3-methoxy-2-(2-methylpentoxy)propyl]-2-methylpropan-2-amine?
The canonical SMILES for N-[3-methoxy-2-(2-methylpentoxy)propyl]-2-methylpropan-2-amine is CCCC(C)COC(CNC(C)(C)C)COC.
What is the InChIKey of N-[3-methoxy-2-(2-methylpentoxy)propyl]-2-methylpropan-2-amine?
The InChIKey is MTPGGCJMLPQRSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H31NO2/c1-7-8-12(2)10-17-13(11-16-6)9-15-14(3,4)5/h12-13,15H,7-11H2,1-6H3.
What are the key properties of N-[3-methoxy-2-(2-methylpentoxy)propyl]-2-methylpropan-2-amine?
N-[3-methoxy-2-(2-methylpentoxy)propyl]-2-methylpropan-2-amine has a molecular weight of 245.41 g/mol, XLogP of 2.84, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-methoxy-2-(2-methylpentoxy)propyl]-2-methylpropan-2-amine is sourced from PubChem (CID 103285718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).