2-[(1-aminocycloheptyl)methoxy]-N-(2-methylpropyl)propanamide

C15H30N2O2 — CID 64551905

IUPAC2-[(1-aminocycloheptyl)methoxy]-N-(2-methylpropyl)propanamide
SMILESCC(C)CNC(=O)C(C)OCC1(N)CCCCCC1
InChIInChI=1S/C15H30N2O2/c1-12(2)10-17-14(18)13(3)19-11-15(16)8-6-4-5-7-9-15/h12-13H,4-11,16H2,1-3H3,(H,17,18)
InChIKeyKFKBWWQOTWCSTF-UHFFFAOYSA-N
MW270.42 g/mol
LogP2.22
Rot. Bonds6

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

2-[(1-aminocycloheptyl)methoxy]-N-(2-methylpropyl)propanamide (PubChem CID 64551905) has the molecular formula C15H30N2O2 and a molecular weight of 270.42 g/mol. Its IUPAC name is 2-[(1-aminocycloheptyl)methoxy]-N-(2-methylpropyl)propanamide.

Molecular Properties

Compound Name2-[(1-aminocycloheptyl)methoxy]-N-(2-methylpropyl)propanamide
PubChem CID64551905
Molecular FormulaC15H30N2O2
Molecular Weight270.42 g/mol
Exact Mass270.23
IUPAC Name2-[(1-aminocycloheptyl)methoxy]-N-(2-methylpropyl)propanamide
SMILESCC(C)CNC(=O)C(C)OCC1(N)CCCCCC1
InChIInChI=1S/C15H30N2O2/c1-12(2)10-17-14(18)13(3)19-11-15(16)8-6-4-5-7-9-15/h12-13H,4-11,16H2,1-3H3,(H,17,18)
InChIKeyKFKBWWQOTWCSTF-UHFFFAOYSA-N
XLogP2.22
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.42
LogP ≤ 52.22
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-pentylpropanamide
CID 64551486
2-[(1-aminocyclohexyl)methoxy]-N-(2-methoxyethyl)propanamide
CID 64572690
2-[(1-aminocycloheptyl)methoxy]-N-prop-2-enylpropanamide
CID 64549565
2-[(1-aminocyclohexyl)methoxy]-N-(ethylcarbamoyl)propanamide
CID 106938268
2-[(1-aminocycloheptyl)methoxy]-N-cyclopentylpropanamide
CID 64549979
2-[(1-aminocycloheptyl)methoxy]-N-(2-methylbutan-2-yl)propanamide
CID 64548742
2-[(1-aminocyclopentyl)methoxy]-N-phenylpropanamide
CID 64574375
2-[(1-aminocyclopentyl)methoxy]-1-(azepan-1-yl)propan-1-one
CID 64572244
(1-aminocyclopentyl)methyl 2-methylpropyl carbonate
CID 79337036
2-[(1-aminocyclopentyl)methoxy]-1-morpholin-4-ylpropan-1-one
CID 64574605
(1-aminocycloheptyl)methyl propan-2-yl carbonate
CID 79337960

Frequently Asked Questions

What is the IUPAC name of 2-[(1-aminocycloheptyl)methoxy]-N-(2-methylpropyl)propanamide?
The IUPAC name of 2-[(1-aminocycloheptyl)methoxy]-N-(2-methylpropyl)propanamide (CID 64551905) is 2-[(1-aminocycloheptyl)methoxy]-N-(2-methylpropyl)propanamide.
What is the SMILES notation for 2-[(1-aminocycloheptyl)methoxy]-N-(2-methylpropyl)propanamide?
The canonical SMILES for 2-[(1-aminocycloheptyl)methoxy]-N-(2-methylpropyl)propanamide is CC(C)CNC(=O)C(C)OCC1(N)CCCCCC1.
What is the InChIKey of 2-[(1-aminocycloheptyl)methoxy]-N-(2-methylpropyl)propanamide?
The InChIKey is KFKBWWQOTWCSTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O2/c1-12(2)10-17-14(18)13(3)19-11-15(16)8-6-4-5-7-9-15/h12-13H,4-11,16H2,1-3H3,(H,17,18).
What are the key properties of 2-[(1-aminocycloheptyl)methoxy]-N-(2-methylpropyl)propanamide?
2-[(1-aminocycloheptyl)methoxy]-N-(2-methylpropyl)propanamide has a molecular weight of 270.42 g/mol, XLogP of 2.22, 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-methylpropyl)propanamide is sourced from PubChem (CID 64551905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).