2-cycloheptyloxy-N-(2-methylpiperidin-4-yl)propanamide

C16H30N2O2 — CID 120601910

IUPAC2-cycloheptyloxy-N-(2-methylpiperidin-4-yl)propanamide
SMILESCC1CC(NC(=O)C(C)OC2CCCCCC2)CCN1
InChIInChI=1S/C16H30N2O2/c1-12-11-14(9-10-17-12)18-16(19)13(2)20-15-7-5-3-4-6-8-15/h12-15,17H,3-11H2,1-2H3,(H,18,19)
InChIKeyNXCYUIBMHJADMR-UHFFFAOYSA-N
MW282.43 g/mol
LogP2.37
Rot. Bonds4

About 2-cycloheptyloxy-N-(2-methylpiperidin-4-yl)propanamide

2-cycloheptyloxy-N-(2-methylpiperidin-4-yl)propanamide (PubChem CID 120601910) has the molecular formula C16H30N2O2 and a molecular weight of 282.43 g/mol. Its IUPAC name is 2-cycloheptyloxy-N-(2-methylpiperidin-4-yl)propanamide.

Molecular Properties

Compound Name2-cycloheptyloxy-N-(2-methylpiperidin-4-yl)propanamide
PubChem CID120601910
Molecular FormulaC16H30N2O2
Molecular Weight282.43 g/mol
Exact Mass282.23
IUPAC Name2-cycloheptyloxy-N-(2-methylpiperidin-4-yl)propanamide
SMILESCC1CC(NC(=O)C(C)OC2CCCCCC2)CCN1
InChIInChI=1S/C16H30N2O2/c1-12-11-14(9-10-17-12)18-16(19)13(2)20-15-7-5-3-4-6-8-15/h12-15,17H,3-11H2,1-2H3,(H,18,19)
InChIKeyNXCYUIBMHJADMR-UHFFFAOYSA-N
XLogP2.37
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.43
LogP ≤ 52.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-methoxy-N-(2-methylpiperidin-4-yl)propanamide
CID 106995606
2-cycloheptyloxy-N-(2-methylpiperidin-3-yl)propanamide
CID 120576393
(2S)-N-cycloheptyl-2-[(1R,3R)-3-methylcyclohexyl]oxypropanamide
CID 99808546
2-(azepan-1-yl)-N-(2-methylpiperidin-4-yl)propanamide
CID 120600315
1-(2-methylpiperidin-4-yl)-3-propan-2-ylurea
CID 106995611
2-cyclohexylsulfonyl-3-methyl-N-(2-methylpiperidin-4-yl)butanamide;hydrochloride
CID 120599357
N-(2-methylpiperidin-4-yl)-2-phenoxypropanamide;hydrochloride
CID 120598370
2-[(2-cyclohexylacetyl)amino]-N-(2-methylpiperidin-4-yl)propanamide;hydrochloride
CID 120601875
[(2R,4R)-2-methylpiperidin-4-yl]carbamic acid
CID 146485805
2-(3,4-dichlorophenoxy)-N-(2-methylpiperidin-4-yl)propanamide;hydrochloride
CID 120600845
4,4-difluoro-N-(2-methylpiperidin-4-yl)cyclohexane-1-carboxamide
CID 106995432
N-(2-methylpiperidin-4-yl)-2-(3-methyl-4-propan-2-ylphenoxy)propanamide;hydrochloride
CID 120599814

Frequently Asked Questions

What is the IUPAC name of 2-cycloheptyloxy-N-(2-methylpiperidin-4-yl)propanamide?
The IUPAC name of 2-cycloheptyloxy-N-(2-methylpiperidin-4-yl)propanamide (CID 120601910) is 2-cycloheptyloxy-N-(2-methylpiperidin-4-yl)propanamide.
What is the SMILES notation for 2-cycloheptyloxy-N-(2-methylpiperidin-4-yl)propanamide?
The canonical SMILES for 2-cycloheptyloxy-N-(2-methylpiperidin-4-yl)propanamide is CC1CC(NC(=O)C(C)OC2CCCCCC2)CCN1.
What is the InChIKey of 2-cycloheptyloxy-N-(2-methylpiperidin-4-yl)propanamide?
The InChIKey is NXCYUIBMHJADMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O2/c1-12-11-14(9-10-17-12)18-16(19)13(2)20-15-7-5-3-4-6-8-15/h12-15,17H,3-11H2,1-2H3,(H,18,19).
What are the key properties of 2-cycloheptyloxy-N-(2-methylpiperidin-4-yl)propanamide?
2-cycloheptyloxy-N-(2-methylpiperidin-4-yl)propanamide has a molecular weight of 282.43 g/mol, XLogP of 2.37, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cycloheptyloxy-N-(2-methylpiperidin-4-yl)propanamide is sourced from PubChem (CID 120601910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).