6-[1-(2-bicyclo[2.2.1]heptanyl)ethylamino]-N,N-dimethylpyridine-3-carboxamide

C17H25N3O — CID 79764561

IUPAC6-[1-(2-bicyclo[2.2.1]heptanyl)ethylamino]-N,N-dimethylpyridine-3-carboxamide
SMILESCC(Nc1ccc(C(=O)N(C)C)cn1)C1CC2CCC1C2
InChIInChI=1S/C17H25N3O/c1-11(15-9-12-4-5-13(15)8-12)19-16-7-6-14(10-18-16)17(21)20(2)3/h6-7,10-13,15H,4-5,8-9H2,1-3H3,(H,18,19)
InChIKeyQRZWSFWTCQAADC-UHFFFAOYSA-N
MW287.41 g/mol
LogP3.02
Rot. Bonds4

About 6-[1-(2-bicyclo[2.2.1]heptanyl)ethylamino]-N,N-dimethylpyridine-3-carboxamide

6-[1-(2-bicyclo[2.2.1]heptanyl)ethylamino]-N,N-dimethylpyridine-3-carboxamide (PubChem CID 79764561) has the molecular formula C17H25N3O and a molecular weight of 287.41 g/mol. Its IUPAC name is 6-[1-(2-bicyclo[2.2.1]heptanyl)ethylamino]-N,N-dimethylpyridine-3-carboxamide.

Molecular Properties

Compound Name6-[1-(2-bicyclo[2.2.1]heptanyl)ethylamino]-N,N-dimethylpyridine-3-carboxamide
PubChem CID79764561
Molecular FormulaC17H25N3O
Molecular Weight287.41 g/mol
Exact Mass287.20
IUPAC Name6-[1-(2-bicyclo[2.2.1]heptanyl)ethylamino]-N,N-dimethylpyridine-3-carboxamide
SMILESCC(Nc1ccc(C(=O)N(C)C)cn1)C1CC2CCC1C2
InChIInChI=1S/C17H25N3O/c1-11(15-9-12-4-5-13(15)8-12)19-16-7-6-14(10-18-16)17(21)20(2)3/h6-7,10-13,15H,4-5,8-9H2,1-3H3,(H,18,19)
InChIKeyQRZWSFWTCQAADC-UHFFFAOYSA-N
XLogP3.02
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.41
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(2-bicyclo[2.2.1]heptanyl)ethyl]-5-chloropyridin-2-amine
CID 43098628
2-amino-N-[5-[1-(2-bicyclo[2.2.1]heptanyl)ethylamino]-2-pyridinyl]acetamide
CID 82034085
6-(3-bicyclo[3.2.1]octanylcarbamoylamino)-N,N-dimethylpyridine-3-carboxamide
CID 138025945
N,N-dimethyl-6-(pentan-3-ylamino)pyridine-3-carboxamide
CID 78956363
6-(2-cyclopropylpropylamino)-N,N-dimethylpyridine-3-carboxamide
CID 115623811
N-[1-(2-bicyclo[2.2.1]heptanyl)ethyl]-5-bromo-4-methylpyridin-2-amine
CID 114869144
N,N-dimethyl-6-[(4-propan-2-ylcycloheptyl)amino]pyridine-3-carboxamide
CID 133479815
(2R)-2-[[(1S)-1-[(1S,2S,4S)-2-bicyclo[2.2.1]heptanyl]ethyl]amino]-N,N-dimethyl-2-phenylacetamide
CID 98690157
N-[1-(2-bicyclo[2.2.1]heptanyl)ethyl]-5-fluoropyrimidin-2-amine
CID 112703061
6-(2,2-dimethylhydrazinyl)-N,N-dimethylpyridine-3-carboxamide
CID 83025620
N-[(1R)-1-[(1R,2R,4R)-2-bicyclo[2.2.1]heptanyl]ethyl]-4-chlorobenzamide
CID 98202188
N-[(1R)-1-[(1R,2R,4R)-2-bicyclo[2.2.1]heptanyl]ethyl]pyridine-4-carboxamide
CID 98104808

Frequently Asked Questions

What is the IUPAC name of 6-[1-(2-bicyclo[2.2.1]heptanyl)ethylamino]-N,N-dimethylpyridine-3-carboxamide?
The IUPAC name of 6-[1-(2-bicyclo[2.2.1]heptanyl)ethylamino]-N,N-dimethylpyridine-3-carboxamide (CID 79764561) is 6-[1-(2-bicyclo[2.2.1]heptanyl)ethylamino]-N,N-dimethylpyridine-3-carboxamide.
What is the SMILES notation for 6-[1-(2-bicyclo[2.2.1]heptanyl)ethylamino]-N,N-dimethylpyridine-3-carboxamide?
The canonical SMILES for 6-[1-(2-bicyclo[2.2.1]heptanyl)ethylamino]-N,N-dimethylpyridine-3-carboxamide is CC(Nc1ccc(C(=O)N(C)C)cn1)C1CC2CCC1C2.
What is the InChIKey of 6-[1-(2-bicyclo[2.2.1]heptanyl)ethylamino]-N,N-dimethylpyridine-3-carboxamide?
The InChIKey is QRZWSFWTCQAADC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O/c1-11(15-9-12-4-5-13(15)8-12)19-16-7-6-14(10-18-16)17(21)20(2)3/h6-7,10-13,15H,4-5,8-9H2,1-3H3,(H,18,19).
What are the key properties of 6-[1-(2-bicyclo[2.2.1]heptanyl)ethylamino]-N,N-dimethylpyridine-3-carboxamide?
6-[1-(2-bicyclo[2.2.1]heptanyl)ethylamino]-N,N-dimethylpyridine-3-carboxamide has a molecular weight of 287.41 g/mol, XLogP of 3.02, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[1-(2-bicyclo[2.2.1]heptanyl)ethylamino]-N,N-dimethylpyridine-3-carboxamide is sourced from PubChem (CID 79764561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).