N-[2-[(1S,2S,4S)-2-bicyclo[2.2.1]heptanyl]ethyl]-6-morpholin-4-ylpyridine-3-carboxamide

C19H27N3O2 — CID 98786152

IUPACN-[2-[(1S,2S,4S)-2-bicyclo[2.2.1]heptanyl]ethyl]-6-morpholin-4-ylpyridine-3-carboxamide
SMILESO=C(NCC[C@@H]1C[C@H]2CC[C@H]1C2)c1ccc(N2CCOCC2)nc1
InChIInChI=1S/C19H27N3O2/c23-19(20-6-5-16-12-14-1-2-15(16)11-14)17-3-4-18(21-13-17)22-7-9-24-10-8-22/h3-4,13-16H,1-2,5-12H2,(H,20,23)/t14-,15-,16+/m0/s1
InChIKeyXQAUYJVTZXPZOD-HRCADAONSA-N
MW329.44 g/mol
LogP2.47
Rot. Bonds5

About N-[2-[(1S,2S,4S)-2-bicyclo[2.2.1]heptanyl]ethyl]-6-morpholin-4-ylpyridine-3-carboxamide

N-[2-[(1S,2S,4S)-2-bicyclo[2.2.1]heptanyl]ethyl]-6-morpholin-4-ylpyridine-3-carboxamide (PubChem CID 98786152) has the molecular formula C19H27N3O2 and a molecular weight of 329.44 g/mol. Its IUPAC name is N-[2-[(1S,2S,4S)-2-bicyclo[2.2.1]heptanyl]ethyl]-6-morpholin-4-ylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-[2-[(1S,2S,4S)-2-bicyclo[2.2.1]heptanyl]ethyl]-6-morpholin-4-ylpyridine-3-carboxamide
PubChem CID98786152
Molecular FormulaC19H27N3O2
Molecular Weight329.44 g/mol
Exact Mass329.21
IUPAC NameN-[2-[(1S,2S,4S)-2-bicyclo[2.2.1]heptanyl]ethyl]-6-morpholin-4-ylpyridine-3-carboxamide
SMILESO=C(NCC[C@@H]1C[C@H]2CC[C@H]1C2)c1ccc(N2CCOCC2)nc1
InChIInChI=1S/C19H27N3O2/c23-19(20-6-5-16-12-14-1-2-15(16)11-14)17-3-4-18(21-13-17)22-7-9-24-10-8-22/h3-4,13-16H,1-2,5-12H2,(H,20,23)/t14-,15-,16+/m0/s1
InChIKeyXQAUYJVTZXPZOD-HRCADAONSA-N
XLogP2.47
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.44
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[2-[(1S,2S,4S)-2-bicyclo[2.2.1]heptanyl]ethyl]-6-morpholin-4-ylpyridine-3-carboxamide with MolForge

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Related Compounds

N-[2-[(2S)-1-methylpiperidin-2-yl]ethyl]-6-morpholin-4-ylpyridine-3-carboxamide
CID 25367128
N-[(1R)-1-[(1S,2R,4S)-2-bicyclo[2.2.1]heptanyl]ethyl]-6-morpholin-4-ylpyridine-3-carboxamide
CID 98750935
N-[2-(2-bicyclo[2.2.1]heptanyl)ethyl]-2-morpholin-4-ylbenzamide
CID 71881693
6-[4-(2-bicyclo[2.2.1]heptanyl)piperazin-1-yl]-N-propylpyridine-3-carboxamide
CID 133344391
6-morpholin-4-yl-N-[[(2S)-oxolan-2-yl]methyl]pyridine-3-carboxamide
CID 724881
6-morpholin-4-yl-N-(2,2,2-trifluoroethyl)pyridine-3-carboxamide
CID 18142338
N-(4-imidazol-1-ylbutyl)-6-morpholin-4-ylpyridine-3-carboxamide
CID 47073596
N-(3-morpholin-4-ylpropyl)-6-pyrrolidin-1-ylpyridine-3-carboxamide
CID 84570657
N-[2-[(1R,2S,4R)-2-bicyclo[2.2.1]heptanyl]ethyl]-2-piperidin-1-ylpyridine-3-carboxamide
CID 98365172
N-[[4-(difluoromethyl)phenyl]methyl]-6-morpholin-4-ylpyridine-3-carboxamide
CID 166216056
N-(1-methylpyrrolidin-3-yl)-6-morpholin-4-ylpyridine-3-carboxamide
CID 72570198
N-[(3R)-1-methylpyrrolidin-3-yl]-6-morpholin-4-ylpyridine-3-carboxamide
CID 59818085

Frequently Asked Questions

What is the IUPAC name of N-[2-[(1S,2S,4S)-2-bicyclo[2.2.1]heptanyl]ethyl]-6-morpholin-4-ylpyridine-3-carboxamide?
The IUPAC name of N-[2-[(1S,2S,4S)-2-bicyclo[2.2.1]heptanyl]ethyl]-6-morpholin-4-ylpyridine-3-carboxamide (CID 98786152) is N-[2-[(1S,2S,4S)-2-bicyclo[2.2.1]heptanyl]ethyl]-6-morpholin-4-ylpyridine-3-carboxamide.
What is the SMILES notation for N-[2-[(1S,2S,4S)-2-bicyclo[2.2.1]heptanyl]ethyl]-6-morpholin-4-ylpyridine-3-carboxamide?
The canonical SMILES for N-[2-[(1S,2S,4S)-2-bicyclo[2.2.1]heptanyl]ethyl]-6-morpholin-4-ylpyridine-3-carboxamide is O=C(NCC[C@@H]1C[C@H]2CC[C@H]1C2)c1ccc(N2CCOCC2)nc1.
What is the InChIKey of N-[2-[(1S,2S,4S)-2-bicyclo[2.2.1]heptanyl]ethyl]-6-morpholin-4-ylpyridine-3-carboxamide?
The InChIKey is XQAUYJVTZXPZOD-HRCADAONSA-N. The full InChI is InChI=1S/C19H27N3O2/c23-19(20-6-5-16-12-14-1-2-15(16)11-14)17-3-4-18(21-13-17)22-7-9-24-10-8-22/h3-4,13-16H,1-2,5-12H2,(H,20,23)/t14-,15-,16+/m0/s1.
What are the key properties of N-[2-[(1S,2S,4S)-2-bicyclo[2.2.1]heptanyl]ethyl]-6-morpholin-4-ylpyridine-3-carboxamide?
N-[2-[(1S,2S,4S)-2-bicyclo[2.2.1]heptanyl]ethyl]-6-morpholin-4-ylpyridine-3-carboxamide has a molecular weight of 329.44 g/mol, XLogP of 2.47, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(1S,2S,4S)-2-bicyclo[2.2.1]heptanyl]ethyl]-6-morpholin-4-ylpyridine-3-carboxamide is sourced from PubChem (CID 98786152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).