N-[(1R,4R,6S)-2-azabicyclo[2.2.1]heptan-6-yl]imidazo[1,5-a]pyridine-7-carboxamide

C14H16N4O — CID 99719092

IUPACN-[(1R,4R,6S)-2-azabicyclo[2.2.1]heptan-6-yl]imidazo[1,5-a]pyridine-7-carboxamide
SMILESO=C(N[C@H]1C[C@@H]2CN[C@@H]1C2)c1ccn2cncc2c1
InChIInChI=1S/C14H16N4O/c19-14(17-13-4-9-3-12(13)16-6-9)10-1-2-18-8-15-7-11(18)5-10/h1-2,5,7-9,12-13,16H,3-4,6H2,(H,17,19)/t9-,12-,13+/m1/s1
InChIKeyINNWBKPIYSNQSN-WQAKAFBOSA-N
MW256.31 g/mol
LogP0.81
Rot. Bonds2

About N-[(1R,4R,6S)-2-azabicyclo[2.2.1]heptan-6-yl]imidazo[1,5-a]pyridine-7-carboxamide

N-[(1R,4R,6S)-2-azabicyclo[2.2.1]heptan-6-yl]imidazo[1,5-a]pyridine-7-carboxamide (PubChem CID 99719092) has the molecular formula C14H16N4O and a molecular weight of 256.31 g/mol. Its IUPAC name is N-[(1R,4R,6S)-2-azabicyclo[2.2.1]heptan-6-yl]imidazo[1,5-a]pyridine-7-carboxamide.

Molecular Properties

Compound NameN-[(1R,4R,6S)-2-azabicyclo[2.2.1]heptan-6-yl]imidazo[1,5-a]pyridine-7-carboxamide
PubChem CID99719092
Molecular FormulaC14H16N4O
Molecular Weight256.31 g/mol
Exact Mass256.13
IUPAC NameN-[(1R,4R,6S)-2-azabicyclo[2.2.1]heptan-6-yl]imidazo[1,5-a]pyridine-7-carboxamide
SMILESO=C(N[C@H]1C[C@@H]2CN[C@@H]1C2)c1ccn2cncc2c1
InChIInChI=1S/C14H16N4O/c19-14(17-13-4-9-3-12(13)16-6-9)10-1-2-18-8-15-7-11(18)5-10/h1-2,5,7-9,12-13,16H,3-4,6H2,(H,17,19)/t9-,12-,13+/m1/s1
InChIKeyINNWBKPIYSNQSN-WQAKAFBOSA-N
XLogP0.81
TPSA58.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.31
LogP ≤ 50.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(1R,4S,6R)-2-azabicyclo[2.2.1]heptan-6-yl]imidazo[1,5-c]pyrimidine-7-carboxamide
CID 99719181
N-(2-azabicyclo[2.2.1]heptan-6-yl)-2-cyanoindolizine-7-carboxamide
CID 22565823
N-[(1R,4R,6S)-2-azabicyclo[2.2.1]heptan-6-yl]imidazo[1,5-a]pyrazine-6-carboxamide
CID 99719176
N-[(1S,4S,6R)-2-azabicyclo[2.2.1]heptan-6-yl]imidazo[1,5-a]pyrazine-6-carboxamide
CID 98077691
N-[(1R,4S,6S)-2-azabicyclo[2.2.1]heptan-6-yl]imidazo[1,2-c]pyrimidine-7-carboxamide
CID 99719189
N-(2-azabicyclo[2.2.1]heptan-6-yl)-5-cyanopyrrolo[1,2-c]pyrimidine-3-carboxamide
CID 22565982
N-[(1R,4R,6S)-2-azabicyclo[2.2.1]heptan-6-yl]-1-benzofuran-5-carboxamide
CID 98096202
N-(2-azabicyclo[2.2.1]heptan-6-yl)-1,3-benzoxazole-5-carboxamide
CID 10214645
N-[1-(2-bicyclo[2.2.1]heptanyl)ethyl]imidazo[1,5-a]pyridine-7-carboxamide
CID 84578331
4-(4-acetylphenoxy)-N-(2-azabicyclo[2.2.1]heptan-6-yl)benzamide
CID 22573564
N-[(1R,4R,6R)-2-azabicyclo[2.2.1]heptan-6-yl]imidazo[1,2-a]pyrazine-6-carboxamide
CID 99719190
N-(2-azabicyclo[2.2.1]heptan-6-yl)-7-chloropyrrolo[1,2-c]pyrimidine-3-carboxamide
CID 22566092

Frequently Asked Questions

What is the IUPAC name of N-[(1R,4R,6S)-2-azabicyclo[2.2.1]heptan-6-yl]imidazo[1,5-a]pyridine-7-carboxamide?
The IUPAC name of N-[(1R,4R,6S)-2-azabicyclo[2.2.1]heptan-6-yl]imidazo[1,5-a]pyridine-7-carboxamide (CID 99719092) is N-[(1R,4R,6S)-2-azabicyclo[2.2.1]heptan-6-yl]imidazo[1,5-a]pyridine-7-carboxamide.
What is the SMILES notation for N-[(1R,4R,6S)-2-azabicyclo[2.2.1]heptan-6-yl]imidazo[1,5-a]pyridine-7-carboxamide?
The canonical SMILES for N-[(1R,4R,6S)-2-azabicyclo[2.2.1]heptan-6-yl]imidazo[1,5-a]pyridine-7-carboxamide is O=C(N[C@H]1C[C@@H]2CN[C@@H]1C2)c1ccn2cncc2c1.
What is the InChIKey of N-[(1R,4R,6S)-2-azabicyclo[2.2.1]heptan-6-yl]imidazo[1,5-a]pyridine-7-carboxamide?
The InChIKey is INNWBKPIYSNQSN-WQAKAFBOSA-N. The full InChI is InChI=1S/C14H16N4O/c19-14(17-13-4-9-3-12(13)16-6-9)10-1-2-18-8-15-7-11(18)5-10/h1-2,5,7-9,12-13,16H,3-4,6H2,(H,17,19)/t9-,12-,13+/m1/s1.
What are the key properties of N-[(1R,4R,6S)-2-azabicyclo[2.2.1]heptan-6-yl]imidazo[1,5-a]pyridine-7-carboxamide?
N-[(1R,4R,6S)-2-azabicyclo[2.2.1]heptan-6-yl]imidazo[1,5-a]pyridine-7-carboxamide has a molecular weight of 256.31 g/mol, XLogP of 0.81, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R,4R,6S)-2-azabicyclo[2.2.1]heptan-6-yl]imidazo[1,5-a]pyridine-7-carboxamide is sourced from PubChem (CID 99719092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).