2-[(1-aminocycloheptyl)methoxy]-N-(2-methylbutan-2-yl)propanamide

C16H32N2O2 — CID 64548742

IUPAC2-[(1-aminocycloheptyl)methoxy]-N-(2-methylbutan-2-yl)propanamide
SMILESCCC(C)(C)NC(=O)C(C)OCC1(N)CCCCCC1
InChIInChI=1S/C16H32N2O2/c1-5-15(3,4)18-14(19)13(2)20-12-16(17)10-8-6-7-9-11-16/h13H,5-12,17H2,1-4H3,(H,18,19)
InChIKeyJOUDWUOXAAISCQ-UHFFFAOYSA-N
MW284.44 g/mol
LogP2.75
Rot. Bonds6

About 2-[(1-aminocycloheptyl)methoxy]-N-(2-methylbutan-2-yl)propanamide

2-[(1-aminocycloheptyl)methoxy]-N-(2-methylbutan-2-yl)propanamide (PubChem CID 64548742) has the molecular formula C16H32N2O2 and a molecular weight of 284.44 g/mol. Its IUPAC name is 2-[(1-aminocycloheptyl)methoxy]-N-(2-methylbutan-2-yl)propanamide.

Molecular Properties

Compound Name2-[(1-aminocycloheptyl)methoxy]-N-(2-methylbutan-2-yl)propanamide
PubChem CID64548742
Molecular FormulaC16H32N2O2
Molecular Weight284.44 g/mol
Exact Mass284.25
IUPAC Name2-[(1-aminocycloheptyl)methoxy]-N-(2-methylbutan-2-yl)propanamide
SMILESCCC(C)(C)NC(=O)C(C)OCC1(N)CCCCCC1
InChIInChI=1S/C16H32N2O2/c1-5-15(3,4)18-14(19)13(2)20-12-16(17)10-8-6-7-9-11-16/h13H,5-12,17H2,1-4H3,(H,18,19)
InChIKeyJOUDWUOXAAISCQ-UHFFFAOYSA-N
XLogP2.75
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.44
LogP ≤ 52.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(1-aminocycloheptyl)methoxy]-N-propan-2-ylpropanamide
CID 64551906
2-[(1-aminocycloheptyl)methoxy]-N-cyclopentylpropanamide
CID 64549979
2-[(1-aminocycloheptyl)methoxy]-N-pentylpropanamide
CID 64551486
2-[(1-aminocycloheptyl)methoxy]-N-(2-methylpropyl)propanamide
CID 64551905
2-[(1-aminocyclohexyl)methoxy]-N-(ethylcarbamoyl)propanamide
CID 106938268
2-aminooxy-N-(2-methylbutan-2-yl)propanamide
CID 79426922
2-[(1-aminocyclohexyl)methoxy]-N-(2-methoxyethyl)propanamide
CID 64572690
2-[(1-aminocycloheptyl)methoxy]-N-prop-2-enylpropanamide
CID 64549565
2-[(1-aminocyclopentyl)methoxy]-N-phenylpropanamide
CID 64574375
2-[(1-aminocyclopentyl)methoxy]-1-(azepan-1-yl)propan-1-one
CID 64572244
ethyl 2-[(1-aminocycloheptyl)methoxy]butanoate
CID 106940160
1-(pentan-2-yloxymethyl)cyclohexan-1-amine
CID 107891879

Frequently Asked Questions

What is the IUPAC name of 2-[(1-aminocycloheptyl)methoxy]-N-(2-methylbutan-2-yl)propanamide?
The IUPAC name of 2-[(1-aminocycloheptyl)methoxy]-N-(2-methylbutan-2-yl)propanamide (CID 64548742) is 2-[(1-aminocycloheptyl)methoxy]-N-(2-methylbutan-2-yl)propanamide.
What is the SMILES notation for 2-[(1-aminocycloheptyl)methoxy]-N-(2-methylbutan-2-yl)propanamide?
The canonical SMILES for 2-[(1-aminocycloheptyl)methoxy]-N-(2-methylbutan-2-yl)propanamide is CCC(C)(C)NC(=O)C(C)OCC1(N)CCCCCC1.
What is the InChIKey of 2-[(1-aminocycloheptyl)methoxy]-N-(2-methylbutan-2-yl)propanamide?
The InChIKey is JOUDWUOXAAISCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O2/c1-5-15(3,4)18-14(19)13(2)20-12-16(17)10-8-6-7-9-11-16/h13H,5-12,17H2,1-4H3,(H,18,19).
What are the key properties of 2-[(1-aminocycloheptyl)methoxy]-N-(2-methylbutan-2-yl)propanamide?
2-[(1-aminocycloheptyl)methoxy]-N-(2-methylbutan-2-yl)propanamide has a molecular weight of 284.44 g/mol, XLogP of 2.75, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1-aminocycloheptyl)methoxy]-N-(2-methylbutan-2-yl)propanamide is sourced from PubChem (CID 64548742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).