N-methyl-1-(2-methyloxolan-3-yl)-1-(2-propan-2-yloxyphenyl)methanamine

C16H25NO2 — CID 105018149

IUPACN-methyl-1-(2-methyloxolan-3-yl)-1-(2-propan-2-yloxyphenyl)methanamine
SMILESCNC(c1ccccc1OC(C)C)C1CCOC1C
InChIInChI=1S/C16H25NO2/c1-11(2)19-15-8-6-5-7-14(15)16(17-4)13-9-10-18-12(13)3/h5-8,11-13,16-17H,9-10H2,1-4H3
InChIKeyMEOTZUJYNGPKEG-UHFFFAOYSA-N
MW263.38 g/mol
LogP3.16
Rot. Bonds5

About N-methyl-1-(2-methyloxolan-3-yl)-1-(2-propan-2-yloxyphenyl)methanamine

N-methyl-1-(2-methyloxolan-3-yl)-1-(2-propan-2-yloxyphenyl)methanamine (PubChem CID 105018149) has the molecular formula C16H25NO2 and a molecular weight of 263.38 g/mol. Its IUPAC name is N-methyl-1-(2-methyloxolan-3-yl)-1-(2-propan-2-yloxyphenyl)methanamine.

Molecular Properties

Compound NameN-methyl-1-(2-methyloxolan-3-yl)-1-(2-propan-2-yloxyphenyl)methanamine
PubChem CID105018149
Molecular FormulaC16H25NO2
Molecular Weight263.38 g/mol
Exact Mass263.19
IUPAC NameN-methyl-1-(2-methyloxolan-3-yl)-1-(2-propan-2-yloxyphenyl)methanamine
SMILESCNC(c1ccccc1OC(C)C)C1CCOC1C
InChIInChI=1S/C16H25NO2/c1-11(2)19-15-8-6-5-7-14(15)16(17-4)13-9-10-18-12(13)3/h5-8,11-13,16-17H,9-10H2,1-4H3
InChIKeyMEOTZUJYNGPKEG-UHFFFAOYSA-N
XLogP3.16
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-1-(3-methyloxolan-2-yl)-1-(2-propan-2-yloxyphenyl)methanamine
CID 105018242
1-(4-methoxynaphthalen-1-yl)-N-methyl-1-(2-methyloxolan-3-yl)methanamine
CID 79755096
[(3-methyloxolan-2-yl)-(2-propan-2-yloxyphenyl)methyl]hydrazine
CID 105326187
1-(5-chloro-2-methoxyphenyl)-N-methyl-1-(2-methyloxolan-3-yl)methanamine
CID 113425485
N-methyl-1-(2-methyloxolan-3-yl)-1-thiophen-2-ylmethanamine
CID 79758920
1-(2,5-dibromo-4-methylphenyl)-N-methyl-1-(2-methyloxolan-3-yl)methanamine
CID 81474158
1-(2-chloro-4-methoxyphenyl)-N-methyl-1-(2-methyloxolan-3-yl)methanamine
CID 79760034
1-isoquinolin-8-yl-N-methyl-1-(2-methyloxolan-3-yl)methanamine
CID 103136814
1-(2-chloro-4,5-difluorophenyl)-N-methyl-1-(2-methyloxolan-3-yl)methanamine
CID 107476133
1-(3-cyclopropyloxyphenyl)-N-methyl-1-(2-methyloxolan-3-yl)methanamine
CID 105051662
1-cyclobutyl-1-(2-methoxyphenyl)-N-methylmethanamine
CID 64986514
N-[1-(2-propan-2-yloxyphenyl)ethyl]cyclopropanamine
CID 103439093

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(2-methyloxolan-3-yl)-1-(2-propan-2-yloxyphenyl)methanamine?
The IUPAC name of N-methyl-1-(2-methyloxolan-3-yl)-1-(2-propan-2-yloxyphenyl)methanamine (CID 105018149) is N-methyl-1-(2-methyloxolan-3-yl)-1-(2-propan-2-yloxyphenyl)methanamine.
What is the SMILES notation for N-methyl-1-(2-methyloxolan-3-yl)-1-(2-propan-2-yloxyphenyl)methanamine?
The canonical SMILES for N-methyl-1-(2-methyloxolan-3-yl)-1-(2-propan-2-yloxyphenyl)methanamine is CNC(c1ccccc1OC(C)C)C1CCOC1C.
What is the InChIKey of N-methyl-1-(2-methyloxolan-3-yl)-1-(2-propan-2-yloxyphenyl)methanamine?
The InChIKey is MEOTZUJYNGPKEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO2/c1-11(2)19-15-8-6-5-7-14(15)16(17-4)13-9-10-18-12(13)3/h5-8,11-13,16-17H,9-10H2,1-4H3.
What are the key properties of N-methyl-1-(2-methyloxolan-3-yl)-1-(2-propan-2-yloxyphenyl)methanamine?
N-methyl-1-(2-methyloxolan-3-yl)-1-(2-propan-2-yloxyphenyl)methanamine has a molecular weight of 263.38 g/mol, XLogP of 3.16, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(2-methyloxolan-3-yl)-1-(2-propan-2-yloxyphenyl)methanamine is sourced from PubChem (CID 105018149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).