N-(2-methyl-2-piperidin-1-ylpropyl)bicyclo[2.2.1]heptane-2-carboxamide

C17H30N2O — CID 134057103

IUPACN-(2-methyl-2-piperidin-1-ylpropyl)bicyclo[2.2.1]heptane-2-carboxamide
SMILESCC(C)(CNC(=O)C1CC2CCC1C2)N1CCCCC1
InChIInChI=1S/C17H30N2O/c1-17(2,19-8-4-3-5-9-19)12-18-16(20)15-11-13-6-7-14(15)10-13/h13-15H,3-12H2,1-2H3,(H,18,20)
InChIKeyWRADSFHOOXNPNT-UHFFFAOYSA-N
MW278.44 g/mol
LogP2.80
Rot. Bonds4

About N-(2-methyl-2-piperidin-1-ylpropyl)bicyclo[2.2.1]heptane-2-carboxamide

N-(2-methyl-2-piperidin-1-ylpropyl)bicyclo[2.2.1]heptane-2-carboxamide (PubChem CID 134057103) has the molecular formula C17H30N2O and a molecular weight of 278.44 g/mol. Its IUPAC name is N-(2-methyl-2-piperidin-1-ylpropyl)bicyclo[2.2.1]heptane-2-carboxamide.

Molecular Properties

Compound NameN-(2-methyl-2-piperidin-1-ylpropyl)bicyclo[2.2.1]heptane-2-carboxamide
PubChem CID134057103
Molecular FormulaC17H30N2O
Molecular Weight278.44 g/mol
Exact Mass278.24
IUPAC NameN-(2-methyl-2-piperidin-1-ylpropyl)bicyclo[2.2.1]heptane-2-carboxamide
SMILESCC(C)(CNC(=O)C1CC2CCC1C2)N1CCCCC1
InChIInChI=1S/C17H30N2O/c1-17(2,19-8-4-3-5-9-19)12-18-16(20)15-11-13-6-7-14(15)10-13/h13-15H,3-12H2,1-2H3,(H,18,20)
InChIKeyWRADSFHOOXNPNT-UHFFFAOYSA-N
XLogP2.80
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.44
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(1S,2S,4S)-N-[2-[[(1S,2S,4S)-bicyclo[2.2.1]heptane-2-carbonyl]amino]ethyl]bicyclo[2.2.1]heptane-2-carboxamide
CID 124716151
(1R,2S,4R)-N-[2-[[(1R,2R,4R)-bicyclo[2.2.1]heptane-2-carbonyl]amino]ethyl]bicyclo[2.2.1]heptane-2-carboxamide
CID 98123961
(1R,2R,4S)-N-propylbicyclo[2.2.1]heptane-2-carboxamide
CID 11074023
N-(2,4,4-trimethylpentan-2-yl)bicyclo[2.2.1]heptane-2-carboxamide
CID 75689779
N-[3-(bicyclo[2.2.1]heptane-2-carbonylamino)propyl]bicyclo[2.2.1]heptane-2-carboxamide
CID 4122681
(1S,2R,4S)-N-[3-(4-acetylpiperazin-1-yl)-3-oxopropyl]bicyclo[2.2.1]heptane-2-carboxamide
CID 98759277
N-[(1-hydroxycyclohexyl)methyl]bicyclo[2.2.1]heptane-2-carboxamide
CID 64867434
N-[(4-chlorocyclohexyl)methyl]bicyclo[2.2.1]heptane-2-carboxamide
CID 106133416
N-(2-methyl-2-morpholin-4-ylpropyl)adamantane-2-carboxamide
CID 51251027
N-(2-amino-2-oxoethyl)bicyclo[2.2.1]heptane-2-carboxamide
CID 10104138
1-(2-bicyclo[2.2.1]heptanyl)-3-(2-methyl-2-morpholin-4-ylpropyl)thiourea
CID 18282847
[(1R,2S,4S)-2-bicyclo[2.2.1]heptanyl]-piperidin-1-ylmethanone
CID 11871768

Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-2-piperidin-1-ylpropyl)bicyclo[2.2.1]heptane-2-carboxamide?
The IUPAC name of N-(2-methyl-2-piperidin-1-ylpropyl)bicyclo[2.2.1]heptane-2-carboxamide (CID 134057103) is N-(2-methyl-2-piperidin-1-ylpropyl)bicyclo[2.2.1]heptane-2-carboxamide.
What is the SMILES notation for N-(2-methyl-2-piperidin-1-ylpropyl)bicyclo[2.2.1]heptane-2-carboxamide?
The canonical SMILES for N-(2-methyl-2-piperidin-1-ylpropyl)bicyclo[2.2.1]heptane-2-carboxamide is CC(C)(CNC(=O)C1CC2CCC1C2)N1CCCCC1.
What is the InChIKey of N-(2-methyl-2-piperidin-1-ylpropyl)bicyclo[2.2.1]heptane-2-carboxamide?
The InChIKey is WRADSFHOOXNPNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N2O/c1-17(2,19-8-4-3-5-9-19)12-18-16(20)15-11-13-6-7-14(15)10-13/h13-15H,3-12H2,1-2H3,(H,18,20).
What are the key properties of N-(2-methyl-2-piperidin-1-ylpropyl)bicyclo[2.2.1]heptane-2-carboxamide?
N-(2-methyl-2-piperidin-1-ylpropyl)bicyclo[2.2.1]heptane-2-carboxamide has a molecular weight of 278.44 g/mol, XLogP of 2.80, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-2-piperidin-1-ylpropyl)bicyclo[2.2.1]heptane-2-carboxamide is sourced from PubChem (CID 134057103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).