3-amino-N-(6-benzamido-3-pyridinyl)bicyclo[2.2.1]heptane-2-carboxamide

C20H22N4O2 — CID 119893876

IUPAC3-amino-N-(6-benzamido-3-pyridinyl)bicyclo[2.2.1]heptane-2-carboxamide
SMILESNC1C2CCC(C2)C1C(=O)Nc1ccc(NC(=O)c2ccccc2)nc1
InChIInChI=1S/C20H22N4O2/c21-18-14-7-6-13(10-14)17(18)20(26)23-15-8-9-16(22-11-15)24-19(25)12-4-2-1-3-5-12/h1-5,8-9,11,13-14,17-18H,6-7,10,21H2,(H,23,26)(H,22,24,25)
InChIKeyNTTUZOZTTNPSTC-UHFFFAOYSA-N
MW350.42 g/mol
LogP2.65
Rot. Bonds4

About 3-amino-N-(6-benzamido-3-pyridinyl)bicyclo[2.2.1]heptane-2-carboxamide

3-amino-N-(6-benzamido-3-pyridinyl)bicyclo[2.2.1]heptane-2-carboxamide (PubChem CID 119893876) has the molecular formula C20H22N4O2 and a molecular weight of 350.42 g/mol. Its IUPAC name is 3-amino-N-(6-benzamido-3-pyridinyl)bicyclo[2.2.1]heptane-2-carboxamide.

Molecular Properties

Compound Name3-amino-N-(6-benzamido-3-pyridinyl)bicyclo[2.2.1]heptane-2-carboxamide
PubChem CID119893876
Molecular FormulaC20H22N4O2
Molecular Weight350.42 g/mol
Exact Mass350.17
IUPAC Name3-amino-N-(6-benzamido-3-pyridinyl)bicyclo[2.2.1]heptane-2-carboxamide
SMILESNC1C2CCC(C2)C1C(=O)Nc1ccc(NC(=O)c2ccccc2)nc1
InChIInChI=1S/C20H22N4O2/c21-18-14-7-6-13(10-14)17(18)20(26)23-15-8-9-16(22-11-15)24-19(25)12-4-2-1-3-5-12/h1-5,8-9,11,13-14,17-18H,6-7,10,21H2,(H,23,26)(H,22,24,25)
InChIKeyNTTUZOZTTNPSTC-UHFFFAOYSA-N
XLogP2.65
TPSA97.11 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.42
LogP ≤ 52.65
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 3-amino-N-(6-benzamido-3-pyridinyl)bicyclo[2.2.1]heptane-2-carboxamide with MolForge

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Related Compounds

3-amino-N-[4-(phenylcarbamoyl)phenyl]bicyclo[2.2.1]heptane-2-carboxamide
CID 119756435
N-[5-[(3-aminocyclohexanecarbonyl)amino]-2-pyridinyl]benzamide
CID 119893878
2-[(6-benzamido-3-pyridinyl)carbamoyl]cyclopropane-1-carboxylic acid
CID 167935918
N-(6-benzamido-3-pyridinyl)piperidine-4-carboxamide
CID 119893870
3-amino-N-[6-(3-carbamoylphenoxy)-3-pyridinyl]bicyclo[2.2.1]heptane-2-carboxamide;dihydrochloride
CID 119872968
3-amino-N-[4-(1-phenylethylamino)phenyl]bicyclo[2.2.1]heptane-2-carboxamide
CID 119743286
N-[5-[[(1S,2S)-2-(1H-1,2,4-triazol-5-yl)cyclopropanecarbonyl]amino]-2-pyridinyl]benzamide
CID 124883118
3-amino-N-[4-(ethylcarbamoyl)phenyl]bicyclo[2.2.1]heptane-2-carboxamide;hydrochloride
CID 119714116
3-amino-N-[4-(prop-2-enylcarbamoyl)phenyl]bicyclo[2.2.1]heptane-2-carboxamide
CID 119740941
3-amino-N-[4-(2-methoxyphenoxy)phenyl]bicyclo[2.2.1]heptane-2-carboxamide
CID 119697295
3-amino-N-[4-methyl-3-(propan-2-ylcarbamoyl)phenyl]bicyclo[2.2.1]heptane-2-carboxamide
CID 119780316
N-[5-(benzylamino)-2-pyridinyl]benzamide
CID 113026368

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(6-benzamido-3-pyridinyl)bicyclo[2.2.1]heptane-2-carboxamide?
The IUPAC name of 3-amino-N-(6-benzamido-3-pyridinyl)bicyclo[2.2.1]heptane-2-carboxamide (CID 119893876) is 3-amino-N-(6-benzamido-3-pyridinyl)bicyclo[2.2.1]heptane-2-carboxamide.
What is the SMILES notation for 3-amino-N-(6-benzamido-3-pyridinyl)bicyclo[2.2.1]heptane-2-carboxamide?
The canonical SMILES for 3-amino-N-(6-benzamido-3-pyridinyl)bicyclo[2.2.1]heptane-2-carboxamide is NC1C2CCC(C2)C1C(=O)Nc1ccc(NC(=O)c2ccccc2)nc1.
What is the InChIKey of 3-amino-N-(6-benzamido-3-pyridinyl)bicyclo[2.2.1]heptane-2-carboxamide?
The InChIKey is NTTUZOZTTNPSTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N4O2/c21-18-14-7-6-13(10-14)17(18)20(26)23-15-8-9-16(22-11-15)24-19(25)12-4-2-1-3-5-12/h1-5,8-9,11,13-14,17-18H,6-7,10,21H2,(H,23,26)(H,22,24,25).
What are the key properties of 3-amino-N-(6-benzamido-3-pyridinyl)bicyclo[2.2.1]heptane-2-carboxamide?
3-amino-N-(6-benzamido-3-pyridinyl)bicyclo[2.2.1]heptane-2-carboxamide has a molecular weight of 350.42 g/mol, XLogP of 2.65, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(6-benzamido-3-pyridinyl)bicyclo[2.2.1]heptane-2-carboxamide is sourced from PubChem (CID 119893876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).