N-(2-bicyclo[2.2.1]heptanyl)pyrrolidine-1-carboxamide

C12H20N2O — CID 115641993

IUPACN-(2-bicyclo[2.2.1]heptanyl)pyrrolidine-1-carboxamide
SMILESO=C(NC1CC2CCC1C2)N1CCCC1
InChIInChI=1S/C12H20N2O/c15-12(14-5-1-2-6-14)13-11-8-9-3-4-10(11)7-9/h9-11H,1-8H2,(H,13,15)
InChIKeyLHUYVEYWVMTNMY-UHFFFAOYSA-N
MW208.30 g/mol
LogP1.98
Rot. Bonds1

About N-(2-bicyclo[2.2.1]heptanyl)pyrrolidine-1-carboxamide

N-(2-bicyclo[2.2.1]heptanyl)pyrrolidine-1-carboxamide (PubChem CID 115641993) has the molecular formula C12H20N2O and a molecular weight of 208.30 g/mol. Its IUPAC name is N-(2-bicyclo[2.2.1]heptanyl)pyrrolidine-1-carboxamide.

Molecular Properties

Compound NameN-(2-bicyclo[2.2.1]heptanyl)pyrrolidine-1-carboxamide
PubChem CID115641993
Molecular FormulaC12H20N2O
Molecular Weight208.30 g/mol
Exact Mass208.16
IUPAC NameN-(2-bicyclo[2.2.1]heptanyl)pyrrolidine-1-carboxamide
SMILESO=C(NC1CC2CCC1C2)N1CCCC1
InChIInChI=1S/C12H20N2O/c15-12(14-5-1-2-6-14)13-11-8-9-3-4-10(11)7-9/h9-11H,1-8H2,(H,13,15)
InChIKeyLHUYVEYWVMTNMY-UHFFFAOYSA-N
XLogP1.98
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.30
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(2-bicyclo[2.2.1]heptanyl)-2-pyrrolidin-1-ylacetamide;hydrochloride
CID 24845342
1-N,3-N,5-N-tris(2-bicyclo[2.2.1]heptanyl)cyclohexane-1,3,5-tricarboxamide
CID 171722556
N-[(1S,2S,4S)-2-bicyclo[2.2.1]heptanyl]cyclohexanecarboxamide
CID 124786150
[(1S,2S,4S)-2-bicyclo[2.2.1]heptanyl]urea
CID 98511353
4-(2-bicyclo[2.2.1]heptanyl)-N-(2-oxo-2-pyrrolidin-1-ylethyl)piperazine-1-carboxamide
CID 71979650
N-(2-methylcycloheptyl)piperidine-1-carboxamide
CID 115665269
1-(2-bicyclo[2.2.1]heptanylcarbamothioyl)pyrrolidine-3-carboxamide
CID 71893772
N-[(1R,2R,4S)-2-bicyclo[2.2.1]heptanyl]-2-chloroacetamide
CID 14619230
N-[(1R,2S,4R)-2-bicyclo[2.2.1]heptanyl]propanamide
CID 98230994
N-[(1R,2S,4S)-2-bicyclo[2.2.1]heptanyl]-1-ethylsulfonylpiperidine-4-carboxamide
CID 95118913
N-[1-(2-bicyclo[2.2.1]heptanyl)ethyl]azepane-1-carboxamide
CID 115583046
1-[(1S,2S,4S)-2-bicyclo[2.2.1]heptanyl]-3-piperidin-1-ylthiourea
CID 98752058

Frequently Asked Questions

What is the IUPAC name of N-(2-bicyclo[2.2.1]heptanyl)pyrrolidine-1-carboxamide?
The IUPAC name of N-(2-bicyclo[2.2.1]heptanyl)pyrrolidine-1-carboxamide (CID 115641993) is N-(2-bicyclo[2.2.1]heptanyl)pyrrolidine-1-carboxamide.
What is the SMILES notation for N-(2-bicyclo[2.2.1]heptanyl)pyrrolidine-1-carboxamide?
The canonical SMILES for N-(2-bicyclo[2.2.1]heptanyl)pyrrolidine-1-carboxamide is O=C(NC1CC2CCC1C2)N1CCCC1.
What is the InChIKey of N-(2-bicyclo[2.2.1]heptanyl)pyrrolidine-1-carboxamide?
The InChIKey is LHUYVEYWVMTNMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O/c15-12(14-5-1-2-6-14)13-11-8-9-3-4-10(11)7-9/h9-11H,1-8H2,(H,13,15).
What are the key properties of N-(2-bicyclo[2.2.1]heptanyl)pyrrolidine-1-carboxamide?
N-(2-bicyclo[2.2.1]heptanyl)pyrrolidine-1-carboxamide has a molecular weight of 208.30 g/mol, XLogP of 1.98, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bicyclo[2.2.1]heptanyl)pyrrolidine-1-carboxamide is sourced from PubChem (CID 115641993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).