2-methyl-N-[(3-methyloxolan-3-yl)methyl]oxolan-3-amine

C11H21NO2 — CID 130626780

IUPAC2-methyl-N-[(3-methyloxolan-3-yl)methyl]oxolan-3-amine
SMILESCC1OCCC1NCC1(C)CCOC1
InChIInChI=1S/C11H21NO2/c1-9-10(3-5-14-9)12-7-11(2)4-6-13-8-11/h9-10,12H,3-8H2,1-2H3
InChIKeyNUMRKUHMSGFJJH-UHFFFAOYSA-N
MW199.29 g/mol
LogP1.18
Rot. Bonds3

About 2-methyl-N-[(3-methyloxolan-3-yl)methyl]oxolan-3-amine

2-methyl-N-[(3-methyloxolan-3-yl)methyl]oxolan-3-amine (PubChem CID 130626780) has the molecular formula C11H21NO2 and a molecular weight of 199.29 g/mol. Its IUPAC name is 2-methyl-N-[(3-methyloxolan-3-yl)methyl]oxolan-3-amine.

Molecular Properties

Compound Name2-methyl-N-[(3-methyloxolan-3-yl)methyl]oxolan-3-amine
PubChem CID130626780
Molecular FormulaC11H21NO2
Molecular Weight199.29 g/mol
Exact Mass199.16
IUPAC Name2-methyl-N-[(3-methyloxolan-3-yl)methyl]oxolan-3-amine
SMILESCC1OCCC1NCC1(C)CCOC1
InChIInChI=1S/C11H21NO2/c1-9-10(3-5-14-9)12-7-11(2)4-6-13-8-11/h9-10,12H,3-8H2,1-2H3
InChIKeyNUMRKUHMSGFJJH-UHFFFAOYSA-N
XLogP1.18
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.29
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-N-[(3-methyloxetan-3-yl)methyl]oxolan-3-amine
CID 115338684
4-methyl-N-[(3-methyloxolan-3-yl)methyl]thiolan-3-amine
CID 130863677
N-[(3-methyloxolan-3-yl)methyl]cyclobutanamine
CID 130621360
ethane;N-methyl-1-(3-methyloxolan-3-yl)methanamine
CID 144998741
N-[(2,2-dimethylcyclopropyl)methyl]-2-methyloxolan-3-amine
CID 103902167
(2S,3R)-2-methyl-N-(2-methylpropyl)oxolan-3-amine
CID 97358057
(2R,3S)-N-(cyclopropylmethyl)-2-methyloxolan-3-amine
CID 97358188
2-methyl-N-(1-oxaspiro[4.4]nonan-2-ylmethyl)oxolan-3-amine
CID 102897677
2-[[(2S,3S)-2-methyloxolan-3-yl]amino]ethanol
CID 99633545
2-methyl-N-propyloxolan-3-amine;hydrochloride
CID 146154013
4-[(3-methyloxolan-3-yl)methylcarbamoyl]cyclohexane-1-carboxylic acid
CID 120673614
N-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]-2-methyloxolan-3-amine
CID 107386372

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(3-methyloxolan-3-yl)methyl]oxolan-3-amine?
The IUPAC name of 2-methyl-N-[(3-methyloxolan-3-yl)methyl]oxolan-3-amine (CID 130626780) is 2-methyl-N-[(3-methyloxolan-3-yl)methyl]oxolan-3-amine.
What is the SMILES notation for 2-methyl-N-[(3-methyloxolan-3-yl)methyl]oxolan-3-amine?
The canonical SMILES for 2-methyl-N-[(3-methyloxolan-3-yl)methyl]oxolan-3-amine is CC1OCCC1NCC1(C)CCOC1.
What is the InChIKey of 2-methyl-N-[(3-methyloxolan-3-yl)methyl]oxolan-3-amine?
The InChIKey is NUMRKUHMSGFJJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO2/c1-9-10(3-5-14-9)12-7-11(2)4-6-13-8-11/h9-10,12H,3-8H2,1-2H3.
What are the key properties of 2-methyl-N-[(3-methyloxolan-3-yl)methyl]oxolan-3-amine?
2-methyl-N-[(3-methyloxolan-3-yl)methyl]oxolan-3-amine has a molecular weight of 199.29 g/mol, XLogP of 1.18, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[(3-methyloxolan-3-yl)methyl]oxolan-3-amine is sourced from PubChem (CID 130626780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).