N-(2-bicyclo[2.2.1]heptanylmethyl)-4-hydroxypyrrolidine-2-carboxamide

C13H22N2O2 — CID 55234438

IUPACN-(2-bicyclo[2.2.1]heptanylmethyl)-4-hydroxypyrrolidine-2-carboxamide
SMILESO=C(NCC1CC2CCC1C2)C1CC(O)CN1
InChIInChI=1S/C13H22N2O2/c16-11-5-12(14-7-11)13(17)15-6-10-4-8-1-2-9(10)3-8/h8-12,14,16H,1-7H2,(H,15,17)
InChIKeyLBIOTVVKTJUIIV-UHFFFAOYSA-N
MW238.33 g/mol
LogP0.26
Rot. Bonds3

About N-(2-bicyclo[2.2.1]heptanylmethyl)-4-hydroxypyrrolidine-2-carboxamide

N-(2-bicyclo[2.2.1]heptanylmethyl)-4-hydroxypyrrolidine-2-carboxamide (PubChem CID 55234438) has the molecular formula C13H22N2O2 and a molecular weight of 238.33 g/mol. Its IUPAC name is N-(2-bicyclo[2.2.1]heptanylmethyl)-4-hydroxypyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-(2-bicyclo[2.2.1]heptanylmethyl)-4-hydroxypyrrolidine-2-carboxamide
PubChem CID55234438
Molecular FormulaC13H22N2O2
Molecular Weight238.33 g/mol
Exact Mass238.17
IUPAC NameN-(2-bicyclo[2.2.1]heptanylmethyl)-4-hydroxypyrrolidine-2-carboxamide
SMILESO=C(NCC1CC2CCC1C2)C1CC(O)CN1
InChIInChI=1S/C13H22N2O2/c16-11-5-12(14-7-11)13(17)15-6-10-4-8-1-2-9(10)3-8/h8-12,14,16H,1-7H2,(H,15,17)
InChIKeyLBIOTVVKTJUIIV-UHFFFAOYSA-N
XLogP0.26
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 50.26
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-bicyclo[2.2.1]heptanyl)-4-hydroxypyrrolidine-2-carboxamide;hydrochloride
CID 119790639
N-(2-bicyclo[2.2.1]heptanylmethyl)-1,3-thiazolidine-4-carboxamide
CID 63683998
(2S)-N-(2-bicyclo[2.2.1]heptanylmethyl)piperidine-2-carboxamide;hydrochloride
CID 119756599
4-hydroxy-N-(thian-4-ylmethyl)pyrrolidine-2-carboxamide;hydrochloride
CID 119756559
N-(azetidin-3-ylmethyl)-4-hydroxypyrrolidine-2-carboxamide;hydrochloride
CID 131159808
4-hydroxy-N-(thiolan-2-ylmethyl)pyrrolidine-2-carboxamide
CID 80584481
(2R,4S)-N-ethyl-4-hydroxypyrrolidine-2-carboxamide
CID 28943534
N-[2-(cyclopropanecarbonylamino)ethyl]-4-hydroxypyrrolidine-2-carboxamide
CID 115738030
N-(2-bicyclo[2.2.1]heptanylmethyl)-5-oxopyrrolidine-3-carboxamide
CID 78991272
2-[[(2S,4S)-4-hydroxypyrrolidine-2-carbonyl]amino]acetic acid
CID 92860822
N-[(2,2-dimethylcyclopropyl)methyl]-4-hydroxypyrrolidine-2-carboxamide;hydrochloride
CID 119785412
4-hydroxy-N-[(1-methylpyrrolidin-2-yl)methyl]pyrrolidine-2-carboxamide;dihydrochloride
CID 119860703

Frequently Asked Questions

What is the IUPAC name of N-(2-bicyclo[2.2.1]heptanylmethyl)-4-hydroxypyrrolidine-2-carboxamide?
The IUPAC name of N-(2-bicyclo[2.2.1]heptanylmethyl)-4-hydroxypyrrolidine-2-carboxamide (CID 55234438) is N-(2-bicyclo[2.2.1]heptanylmethyl)-4-hydroxypyrrolidine-2-carboxamide.
What is the SMILES notation for N-(2-bicyclo[2.2.1]heptanylmethyl)-4-hydroxypyrrolidine-2-carboxamide?
The canonical SMILES for N-(2-bicyclo[2.2.1]heptanylmethyl)-4-hydroxypyrrolidine-2-carboxamide is O=C(NCC1CC2CCC1C2)C1CC(O)CN1.
What is the InChIKey of N-(2-bicyclo[2.2.1]heptanylmethyl)-4-hydroxypyrrolidine-2-carboxamide?
The InChIKey is LBIOTVVKTJUIIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O2/c16-11-5-12(14-7-11)13(17)15-6-10-4-8-1-2-9(10)3-8/h8-12,14,16H,1-7H2,(H,15,17).
What are the key properties of N-(2-bicyclo[2.2.1]heptanylmethyl)-4-hydroxypyrrolidine-2-carboxamide?
N-(2-bicyclo[2.2.1]heptanylmethyl)-4-hydroxypyrrolidine-2-carboxamide has a molecular weight of 238.33 g/mol, XLogP of 0.26, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bicyclo[2.2.1]heptanylmethyl)-4-hydroxypyrrolidine-2-carboxamide is sourced from PubChem (CID 55234438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).