N-(2-bicyclo[2.2.1]heptanylmethyl)-3-piperidin-4-yloxypropanamide

C16H28N2O2 — CID 63904900

IUPACN-(2-bicyclo[2.2.1]heptanylmethyl)-3-piperidin-4-yloxypropanamide
SMILESO=C(CCOC1CCNCC1)NCC1CC2CCC1C2
InChIInChI=1S/C16H28N2O2/c19-16(5-8-20-15-3-6-17-7-4-15)18-11-14-10-12-1-2-13(14)9-12/h12-15,17H,1-11H2,(H,18,19)
InChIKeyAHYCCYARBUZLTG-UHFFFAOYSA-N
MW280.41 g/mol
LogP1.70
Rot. Bonds6

About N-(2-bicyclo[2.2.1]heptanylmethyl)-3-piperidin-4-yloxypropanamide

N-(2-bicyclo[2.2.1]heptanylmethyl)-3-piperidin-4-yloxypropanamide (PubChem CID 63904900) has the molecular formula C16H28N2O2 and a molecular weight of 280.41 g/mol. Its IUPAC name is N-(2-bicyclo[2.2.1]heptanylmethyl)-3-piperidin-4-yloxypropanamide.

Molecular Properties

Compound NameN-(2-bicyclo[2.2.1]heptanylmethyl)-3-piperidin-4-yloxypropanamide
PubChem CID63904900
Molecular FormulaC16H28N2O2
Molecular Weight280.41 g/mol
Exact Mass280.22
IUPAC NameN-(2-bicyclo[2.2.1]heptanylmethyl)-3-piperidin-4-yloxypropanamide
SMILESO=C(CCOC1CCNCC1)NCC1CC2CCC1C2
InChIInChI=1S/C16H28N2O2/c19-16(5-8-20-15-3-6-17-7-4-15)18-11-14-10-12-1-2-13(14)9-12/h12-15,17H,1-11H2,(H,18,19)
InChIKeyAHYCCYARBUZLTG-UHFFFAOYSA-N
XLogP1.70
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.41
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-bicyclo[2.2.1]heptanylmethyl)-3-piperidin-4-ylpropanamide
CID 63682104
2-(2-bicyclo[2.2.1]heptanyl)-N-(3-piperidin-4-yloxypropyl)acetamide
CID 63870947
N-[(3-hydroxycyclobutyl)methyl]-3-piperidin-4-yloxypropanamide
CID 66007009
N-[(3-hydroxycyclopentyl)methyl]-3-piperidin-4-yloxypropanamide
CID 106133903
N-(2-amino-2-oxoethyl)-3-piperidin-4-yloxypropanamide
CID 63875429
3-piperidin-4-yloxy-N-prop-2-enylpropanamide
CID 63875272
2-(2-bicyclo[2.2.1]heptanyl)-N-(pyrrolidin-3-ylmethyl)acetamide
CID 80564596
N-[(1,1-dioxothiolan-2-yl)methyl]-3-piperidin-4-yloxypropanamide
CID 81039234
N-[[(1R,2R,4R)-2-bicyclo[2.2.1]heptanyl]methyl]-3-oxobutanamide
CID 98153784
2-methyl-N-[2-(3-piperidin-4-yloxypropanoylamino)ethyl]propanamide
CID 63904487
N-[2-(dimethylamino)-2-oxoethyl]-3-piperidin-4-yloxypropanamide
CID 63874940
N-(2,3-dimethylbutyl)-3-piperidin-4-yloxypropanamide
CID 64599298

Frequently Asked Questions

What is the IUPAC name of N-(2-bicyclo[2.2.1]heptanylmethyl)-3-piperidin-4-yloxypropanamide?
The IUPAC name of N-(2-bicyclo[2.2.1]heptanylmethyl)-3-piperidin-4-yloxypropanamide (CID 63904900) is N-(2-bicyclo[2.2.1]heptanylmethyl)-3-piperidin-4-yloxypropanamide.
What is the SMILES notation for N-(2-bicyclo[2.2.1]heptanylmethyl)-3-piperidin-4-yloxypropanamide?
The canonical SMILES for N-(2-bicyclo[2.2.1]heptanylmethyl)-3-piperidin-4-yloxypropanamide is O=C(CCOC1CCNCC1)NCC1CC2CCC1C2.
What is the InChIKey of N-(2-bicyclo[2.2.1]heptanylmethyl)-3-piperidin-4-yloxypropanamide?
The InChIKey is AHYCCYARBUZLTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2O2/c19-16(5-8-20-15-3-6-17-7-4-15)18-11-14-10-12-1-2-13(14)9-12/h12-15,17H,1-11H2,(H,18,19).
What are the key properties of N-(2-bicyclo[2.2.1]heptanylmethyl)-3-piperidin-4-yloxypropanamide?
N-(2-bicyclo[2.2.1]heptanylmethyl)-3-piperidin-4-yloxypropanamide has a molecular weight of 280.41 g/mol, XLogP of 1.70, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bicyclo[2.2.1]heptanylmethyl)-3-piperidin-4-yloxypropanamide is sourced from PubChem (CID 63904900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).