N-(4-aminocyclohexyl)-2-methoxy-N-methylpropanamide

C11H22N2O2 — CID 115737651

IUPACN-(4-aminocyclohexyl)-2-methoxy-N-methylpropanamide
SMILESCOC(C)C(=O)N(C)C1CCC(N)CC1
InChIInChI=1S/C11H22N2O2/c1-8(15-3)11(14)13(2)10-6-4-9(12)5-7-10/h8-10H,4-7,12H2,1-3H3
InChIKeyMULAHGXKAQBJNH-UHFFFAOYSA-N
MW214.31 g/mol
LogP0.75
Rot. Bonds3

About N-(4-aminocyclohexyl)-2-methoxy-N-methylpropanamide

N-(4-aminocyclohexyl)-2-methoxy-N-methylpropanamide (PubChem CID 115737651) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is N-(4-aminocyclohexyl)-2-methoxy-N-methylpropanamide.

Molecular Properties

Compound NameN-(4-aminocyclohexyl)-2-methoxy-N-methylpropanamide
PubChem CID115737651
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC NameN-(4-aminocyclohexyl)-2-methoxy-N-methylpropanamide
SMILESCOC(C)C(=O)N(C)C1CCC(N)CC1
InChIInChI=1S/C11H22N2O2/c1-8(15-3)11(14)13(2)10-6-4-9(12)5-7-10/h8-10H,4-7,12H2,1-3H3
InChIKeyMULAHGXKAQBJNH-UHFFFAOYSA-N
XLogP0.75
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 50.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(4-aminocyclohexyl)-2-methoxy-N-methylpropanamide?
The IUPAC name of N-(4-aminocyclohexyl)-2-methoxy-N-methylpropanamide (CID 115737651) is N-(4-aminocyclohexyl)-2-methoxy-N-methylpropanamide.
What is the SMILES notation for N-(4-aminocyclohexyl)-2-methoxy-N-methylpropanamide?
The canonical SMILES for N-(4-aminocyclohexyl)-2-methoxy-N-methylpropanamide is COC(C)C(=O)N(C)C1CCC(N)CC1.
What is the InChIKey of N-(4-aminocyclohexyl)-2-methoxy-N-methylpropanamide?
The InChIKey is MULAHGXKAQBJNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-8(15-3)11(14)13(2)10-6-4-9(12)5-7-10/h8-10H,4-7,12H2,1-3H3.
What are the key properties of N-(4-aminocyclohexyl)-2-methoxy-N-methylpropanamide?
N-(4-aminocyclohexyl)-2-methoxy-N-methylpropanamide has a molecular weight of 214.31 g/mol, XLogP of 0.75, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-aminocyclohexyl)-2-methoxy-N-methylpropanamide is sourced from PubChem (CID 115737651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).