1-[3-(cyclopropylmethoxymethyl)-2-methyloxolan-3-yl]-N-methylmethanamine

C12H23NO2 — CID 106930994

IUPAC1-[3-(cyclopropylmethoxymethyl)-2-methyloxolan-3-yl]-N-methylmethanamine
SMILESCNCC1(COCC2CC2)CCOC1C
InChIInChI=1S/C12H23NO2/c1-10-12(8-13-2,5-6-15-10)9-14-7-11-3-4-11/h10-11,13H,3-9H2,1-2H3
InChIKeyCIUGGYZHXFJWIC-UHFFFAOYSA-N
MW213.32 g/mol
LogP1.43
Rot. Bonds6

About 1-[3-(cyclopropylmethoxymethyl)-2-methyloxolan-3-yl]-N-methylmethanamine

1-[3-(cyclopropylmethoxymethyl)-2-methyloxolan-3-yl]-N-methylmethanamine (PubChem CID 106930994) has the molecular formula C12H23NO2 and a molecular weight of 213.32 g/mol. Its IUPAC name is 1-[3-(cyclopropylmethoxymethyl)-2-methyloxolan-3-yl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[3-(cyclopropylmethoxymethyl)-2-methyloxolan-3-yl]-N-methylmethanamine
PubChem CID106930994
Molecular FormulaC12H23NO2
Molecular Weight213.32 g/mol
Exact Mass213.17
IUPAC Name1-[3-(cyclopropylmethoxymethyl)-2-methyloxolan-3-yl]-N-methylmethanamine
SMILESCNCC1(COCC2CC2)CCOC1C
InChIInChI=1S/C12H23NO2/c1-10-12(8-13-2,5-6-15-10)9-14-7-11-3-4-11/h10-11,13H,3-9H2,1-2H3
InChIKeyCIUGGYZHXFJWIC-UHFFFAOYSA-N
XLogP1.43
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[3-(ethoxymethyl)-2-methyloxolan-3-yl]-N-methylmethanamine
CID 114534229
1-(3-ethyl-2-methyloxolan-3-yl)-N-methylmethanamine
CID 114534117
1-[3-(cyclopropylmethoxymethyl)oxolan-3-yl]-N-methylmethanamine
CID 106930797
N-[[2-cyclopropyl-3-(cyclopropylmethoxymethyl)oxolan-3-yl]methyl]-2-methylpropan-1-amine
CID 106930991
N-[[3-(ethoxymethyl)-2-methyloxolan-3-yl]methyl]-2-methylpropan-1-amine
CID 114535154
2-methyl-N-[[2-methyl-3-(2,2,2-trifluoroethoxymethyl)oxolan-3-yl]methyl]propan-2-amine
CID 106706226
N-[[2-methyl-3-(2,2,2-trifluoroethoxymethyl)oxolan-3-yl]methyl]propan-2-amine
CID 106706225
N-methyl-1-[2-methyl-3-(3-methylsulfonylpropyl)oxolan-3-yl]methanamine
CID 114534203
N-methyl-1-[4-methyl-1-(oxan-4-ylmethoxy)cyclohexyl]methanamine
CID 62382213
3-(cyclopropylmethoxy)-N-methylpropan-1-amine
CID 60697422
1-[3-[(5-bromo-2-methoxyphenyl)methyl]-2-methyloxolan-3-yl]-N-methylmethanamine
CID 114534147
[3-(hydroxymethyl)-2-methyloxolan-3-yl]methanol
CID 130490555

Frequently Asked Questions

What is the IUPAC name of 1-[3-(cyclopropylmethoxymethyl)-2-methyloxolan-3-yl]-N-methylmethanamine?
The IUPAC name of 1-[3-(cyclopropylmethoxymethyl)-2-methyloxolan-3-yl]-N-methylmethanamine (CID 106930994) is 1-[3-(cyclopropylmethoxymethyl)-2-methyloxolan-3-yl]-N-methylmethanamine.
What is the SMILES notation for 1-[3-(cyclopropylmethoxymethyl)-2-methyloxolan-3-yl]-N-methylmethanamine?
The canonical SMILES for 1-[3-(cyclopropylmethoxymethyl)-2-methyloxolan-3-yl]-N-methylmethanamine is CNCC1(COCC2CC2)CCOC1C.
What is the InChIKey of 1-[3-(cyclopropylmethoxymethyl)-2-methyloxolan-3-yl]-N-methylmethanamine?
The InChIKey is CIUGGYZHXFJWIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO2/c1-10-12(8-13-2,5-6-15-10)9-14-7-11-3-4-11/h10-11,13H,3-9H2,1-2H3.
What are the key properties of 1-[3-(cyclopropylmethoxymethyl)-2-methyloxolan-3-yl]-N-methylmethanamine?
1-[3-(cyclopropylmethoxymethyl)-2-methyloxolan-3-yl]-N-methylmethanamine has a molecular weight of 213.32 g/mol, XLogP of 1.43, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(cyclopropylmethoxymethyl)-2-methyloxolan-3-yl]-N-methylmethanamine is sourced from PubChem (CID 106930994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).