4-methoxy-N,4-dimethyl-1-(2-methyloxan-2-yl)pentan-1-amine

C14H29NO2 — CID 103035951

IUPAC4-methoxy-N,4-dimethyl-1-(2-methyloxan-2-yl)pentan-1-amine
SMILESCNC(CCC(C)(C)OC)C1(C)CCCCO1
InChIInChI=1S/C14H29NO2/c1-13(2,16-5)10-8-12(15-4)14(3)9-6-7-11-17-14/h12,15H,6-11H2,1-5H3
InChIKeyDIWFMRYEXFDWFQ-UHFFFAOYSA-N
MW243.39 g/mol
LogP2.74
Rot. Bonds6

About 4-methoxy-N,4-dimethyl-1-(2-methyloxan-2-yl)pentan-1-amine

4-methoxy-N,4-dimethyl-1-(2-methyloxan-2-yl)pentan-1-amine (PubChem CID 103035951) has the molecular formula C14H29NO2 and a molecular weight of 243.39 g/mol. Its IUPAC name is 4-methoxy-N,4-dimethyl-1-(2-methyloxan-2-yl)pentan-1-amine.

Molecular Properties

Compound Name4-methoxy-N,4-dimethyl-1-(2-methyloxan-2-yl)pentan-1-amine
PubChem CID103035951
Molecular FormulaC14H29NO2
Molecular Weight243.39 g/mol
Exact Mass243.22
IUPAC Name4-methoxy-N,4-dimethyl-1-(2-methyloxan-2-yl)pentan-1-amine
SMILESCNC(CCC(C)(C)OC)C1(C)CCCCO1
InChIInChI=1S/C14H29NO2/c1-13(2,16-5)10-8-12(15-4)14(3)9-6-7-11-17-14/h12,15H,6-11H2,1-5H3
InChIKeyDIWFMRYEXFDWFQ-UHFFFAOYSA-N
XLogP2.74
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.39
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-4-methoxy-4-methyl-1-(oxan-4-yl)pentan-1-amine
CID 103031101
1-ethoxy-5-methoxy-N,5-dimethylhexan-2-amine
CID 103031121
1,5-dimethoxy-5-methyl-N-propylhexan-2-amine
CID 103031139
1,5-dimethoxy-N,5-dimethylhexan-2-amine
CID 103031140
4-methoxy-4-methyl-1-(5-methyloxolan-2-yl)-N-propylpentan-1-amine
CID 103031267
1-ethoxy-5-methoxy-5-methyl-N-propylhexan-2-amine
CID 103031299
6-methoxy-N,6-dimethyl-1-(oxan-2-yl)heptan-3-amine
CID 103031425
4-methoxy-4-methyl-1-(oxolan-2-yl)-N-propylpentan-1-amine
CID 103031485
1-(1,4-dioxan-2-yl)-4-methoxy-N,4-dimethylpentan-1-amine
CID 103031578
N-ethyl-5-methoxy-5-methyl-1-propan-2-yloxyhexan-2-amine
CID 103031587
2,6-dimethoxy-N,6-dimethylheptan-3-amine
CID 103031620
2,6-dimethoxy-6-methyl-N-propylheptan-3-amine
CID 103031782

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N,4-dimethyl-1-(2-methyloxan-2-yl)pentan-1-amine?
The IUPAC name of 4-methoxy-N,4-dimethyl-1-(2-methyloxan-2-yl)pentan-1-amine (CID 103035951) is 4-methoxy-N,4-dimethyl-1-(2-methyloxan-2-yl)pentan-1-amine.
What is the SMILES notation for 4-methoxy-N,4-dimethyl-1-(2-methyloxan-2-yl)pentan-1-amine?
The canonical SMILES for 4-methoxy-N,4-dimethyl-1-(2-methyloxan-2-yl)pentan-1-amine is CNC(CCC(C)(C)OC)C1(C)CCCCO1.
What is the InChIKey of 4-methoxy-N,4-dimethyl-1-(2-methyloxan-2-yl)pentan-1-amine?
The InChIKey is DIWFMRYEXFDWFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29NO2/c1-13(2,16-5)10-8-12(15-4)14(3)9-6-7-11-17-14/h12,15H,6-11H2,1-5H3.
What are the key properties of 4-methoxy-N,4-dimethyl-1-(2-methyloxan-2-yl)pentan-1-amine?
4-methoxy-N,4-dimethyl-1-(2-methyloxan-2-yl)pentan-1-amine has a molecular weight of 243.39 g/mol, XLogP of 2.74, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N,4-dimethyl-1-(2-methyloxan-2-yl)pentan-1-amine is sourced from PubChem (CID 103035951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).