N-methyl-1-(2-methylcyclopropyl)-1-(oxan-4-yl)methanamine

C11H21NO — CID 65421926

IUPACN-methyl-1-(2-methylcyclopropyl)-1-(oxan-4-yl)methanamine
SMILESCNC(C1CCOCC1)C1CC1C
InChIInChI=1S/C11H21NO/c1-8-7-10(8)11(12-2)9-3-5-13-6-4-9/h8-12H,3-7H2,1-2H3
InChIKeyLJENOHAOVNQLOF-UHFFFAOYSA-N
MW183.29 g/mol
LogP1.66
Rot. Bonds3

About N-methyl-1-(2-methylcyclopropyl)-1-(oxan-4-yl)methanamine

N-methyl-1-(2-methylcyclopropyl)-1-(oxan-4-yl)methanamine (PubChem CID 65421926) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is N-methyl-1-(2-methylcyclopropyl)-1-(oxan-4-yl)methanamine.

Molecular Properties

Compound NameN-methyl-1-(2-methylcyclopropyl)-1-(oxan-4-yl)methanamine
PubChem CID65421926
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC NameN-methyl-1-(2-methylcyclopropyl)-1-(oxan-4-yl)methanamine
SMILESCNC(C1CCOCC1)C1CC1C
InChIInChI=1S/C11H21NO/c1-8-7-10(8)11(12-2)9-3-5-13-6-4-9/h8-12H,3-7H2,1-2H3
InChIKeyLJENOHAOVNQLOF-UHFFFAOYSA-N
XLogP1.66
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-1-(oxan-4-yl)-1-(oxolan-3-yl)methanamine
CID 65330243
1-cycloheptyl-N-methyl-1-(oxan-4-yl)methanamine
CID 65399325
1-(2,6-dioxaspiro[4.5]decan-9-yl)-N-methyl-1-(2-methylcyclopropyl)methanamine
CID 79911605
N-[(2-methylcyclopropyl)-(oxolan-3-yl)methyl]ethanamine
CID 65419974
1-(3,5-dimethylcyclohexyl)-N-methyl-1-(oxolan-3-yl)methanamine
CID 65330300
N-methyl-1-(3-methylcyclopentyl)-1-(oxolan-3-yl)methanamine
CID 65414174
1-cyclooctyl-N-methyl-1-(oxolan-3-yl)methanamine
CID 80603950
1-(2,3-dihydro-1H-inden-2-yl)-N-methyl-1-(oxan-4-yl)methanamine
CID 65410719
1-(3-ethylcyclohexyl)-N-methyl-1-(2-methylcyclopropyl)methanamine
CID 65422358
[oxan-4-yl-(4-propan-2-ylcyclohexyl)methyl]hydrazine
CID 105232457
N,N'-dimethyl-1-(oxan-4-yl)ethane-1,2-diamine
CID 116948007
N-methyl-1-(oxolan-3-yl)-1-(2,4,5-trimethyloxolan-3-yl)methanamine
CID 115856404

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(2-methylcyclopropyl)-1-(oxan-4-yl)methanamine?
The IUPAC name of N-methyl-1-(2-methylcyclopropyl)-1-(oxan-4-yl)methanamine (CID 65421926) is N-methyl-1-(2-methylcyclopropyl)-1-(oxan-4-yl)methanamine.
What is the SMILES notation for N-methyl-1-(2-methylcyclopropyl)-1-(oxan-4-yl)methanamine?
The canonical SMILES for N-methyl-1-(2-methylcyclopropyl)-1-(oxan-4-yl)methanamine is CNC(C1CCOCC1)C1CC1C.
What is the InChIKey of N-methyl-1-(2-methylcyclopropyl)-1-(oxan-4-yl)methanamine?
The InChIKey is LJENOHAOVNQLOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-8-7-10(8)11(12-2)9-3-5-13-6-4-9/h8-12H,3-7H2,1-2H3.
What are the key properties of N-methyl-1-(2-methylcyclopropyl)-1-(oxan-4-yl)methanamine?
N-methyl-1-(2-methylcyclopropyl)-1-(oxan-4-yl)methanamine has a molecular weight of 183.29 g/mol, XLogP of 1.66, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(2-methylcyclopropyl)-1-(oxan-4-yl)methanamine is sourced from PubChem (CID 65421926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).