N-(5-amino-3-methyl-2-pyridinyl)bicyclo[2.2.1]heptane-2-carboxamide

C14H19N3O — CID 112555408

IUPACN-(5-amino-3-methyl-2-pyridinyl)bicyclo[2.2.1]heptane-2-carboxamide
SMILESCc1cc(N)cnc1NC(=O)C1CC2CCC1C2
InChIInChI=1S/C14H19N3O/c1-8-4-11(15)7-16-13(8)17-14(18)12-6-9-2-3-10(12)5-9/h4,7,9-10,12H,2-3,5-6,15H2,1H3,(H,16,17,18)
InChIKeyRXGPNVWFJKTSDV-UHFFFAOYSA-N
MW245.33 g/mol
LogP2.35
Rot. Bonds2

About N-(5-amino-3-methyl-2-pyridinyl)bicyclo[2.2.1]heptane-2-carboxamide

N-(5-amino-3-methyl-2-pyridinyl)bicyclo[2.2.1]heptane-2-carboxamide (PubChem CID 112555408) has the molecular formula C14H19N3O and a molecular weight of 245.33 g/mol. Its IUPAC name is N-(5-amino-3-methyl-2-pyridinyl)bicyclo[2.2.1]heptane-2-carboxamide.

Molecular Properties

Compound NameN-(5-amino-3-methyl-2-pyridinyl)bicyclo[2.2.1]heptane-2-carboxamide
PubChem CID112555408
Molecular FormulaC14H19N3O
Molecular Weight245.33 g/mol
Exact Mass245.15
IUPAC NameN-(5-amino-3-methyl-2-pyridinyl)bicyclo[2.2.1]heptane-2-carboxamide
SMILESCc1cc(N)cnc1NC(=O)C1CC2CCC1C2
InChIInChI=1S/C14H19N3O/c1-8-4-11(15)7-16-13(8)17-14(18)12-6-9-2-3-10(12)5-9/h4,7,9-10,12H,2-3,5-6,15H2,1H3,(H,16,17,18)
InChIKeyRXGPNVWFJKTSDV-UHFFFAOYSA-N
XLogP2.35
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.33
LogP ≤ 52.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(1S,2S,4S)-N-(3-methyl-2-pyridinyl)bicyclo[2.2.1]heptane-2-carboxamide
CID 7083370
N-(5-amino-3-methyl-2-pyridinyl)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene-2-carboxamide
CID 115910697
N-(5-amino-2-pyridinyl)bicyclo[2.2.1]heptane-2-carboxamide
CID 61364724
(1R,2S,4S)-N-(3,5-dimethylphenyl)bicyclo[2.2.1]heptane-2-carboxamide
CID 11905183
2-N-(2-bicyclo[2.2.1]heptanylmethyl)-3-methylpyridine-2,5-diamine
CID 63689946
N-(2,4,6-trimethylphenyl)bicyclo[2.2.1]heptane-2-carboxamide
CID 3111211
(1S,2S,4R)-N-(2,4,6-trimethylphenyl)bicyclo[2.2.1]heptane-2-carboxamide
CID 98142401
N-(5-methyl-1H-pyrazol-3-yl)bicyclo[2.2.1]heptane-2-carboxamide
CID 47289727
(1R,2R,4R)-N-(5-methyl-2-pyridinyl)bicyclo[2.2.1]heptane-2-carboxamide
CID 98280304
(1R,2R,4S)-N-(5-methyl-2-pyridinyl)bicyclo[2.2.1]heptane-2-carboxamide
CID 40530150
(1R,2R,4R)-N-(4-methyl-1,3-thiazol-2-yl)bicyclo[2.2.1]heptane-2-carboxamide
CID 98277438
(1R,2S,4S)-N-(5-methyl-1,2-oxazol-3-yl)bicyclo[2.2.1]heptane-2-carboxamide
CID 6593221

Frequently Asked Questions

What is the IUPAC name of N-(5-amino-3-methyl-2-pyridinyl)bicyclo[2.2.1]heptane-2-carboxamide?
The IUPAC name of N-(5-amino-3-methyl-2-pyridinyl)bicyclo[2.2.1]heptane-2-carboxamide (CID 112555408) is N-(5-amino-3-methyl-2-pyridinyl)bicyclo[2.2.1]heptane-2-carboxamide.
What is the SMILES notation for N-(5-amino-3-methyl-2-pyridinyl)bicyclo[2.2.1]heptane-2-carboxamide?
The canonical SMILES for N-(5-amino-3-methyl-2-pyridinyl)bicyclo[2.2.1]heptane-2-carboxamide is Cc1cc(N)cnc1NC(=O)C1CC2CCC1C2.
What is the InChIKey of N-(5-amino-3-methyl-2-pyridinyl)bicyclo[2.2.1]heptane-2-carboxamide?
The InChIKey is RXGPNVWFJKTSDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O/c1-8-4-11(15)7-16-13(8)17-14(18)12-6-9-2-3-10(12)5-9/h4,7,9-10,12H,2-3,5-6,15H2,1H3,(H,16,17,18).
What are the key properties of N-(5-amino-3-methyl-2-pyridinyl)bicyclo[2.2.1]heptane-2-carboxamide?
N-(5-amino-3-methyl-2-pyridinyl)bicyclo[2.2.1]heptane-2-carboxamide has a molecular weight of 245.33 g/mol, XLogP of 2.35, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-amino-3-methyl-2-pyridinyl)bicyclo[2.2.1]heptane-2-carboxamide is sourced from PubChem (CID 112555408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).