6-(3-bicyclo[3.2.1]octanylcarbamoylamino)-N,N-dimethylpyridine-3-carboxamide

C17H24N4O2 — CID 138025945

IUPAC6-(3-bicyclo[3.2.1]octanylcarbamoylamino)-N,N-dimethylpyridine-3-carboxamide
SMILESCN(C)C(=O)c1ccc(NC(=O)NC2CC3CCC(C3)C2)nc1
InChIInChI=1S/C17H24N4O2/c1-21(2)16(22)13-5-6-15(18-10-13)20-17(23)19-14-8-11-3-4-12(7-11)9-14/h5-6,10-12,14H,3-4,7-9H2,1-2H3,(H2,18,19,20,23)
InChIKeyGFZANEXJQPBCBQ-UHFFFAOYSA-N
MW316.41 g/mol
LogP2.48
Rot. Bonds3

About 6-(3-bicyclo[3.2.1]octanylcarbamoylamino)-N,N-dimethylpyridine-3-carboxamide

6-(3-bicyclo[3.2.1]octanylcarbamoylamino)-N,N-dimethylpyridine-3-carboxamide (PubChem CID 138025945) has the molecular formula C17H24N4O2 and a molecular weight of 316.41 g/mol. Its IUPAC name is 6-(3-bicyclo[3.2.1]octanylcarbamoylamino)-N,N-dimethylpyridine-3-carboxamide.

Molecular Properties

Compound Name6-(3-bicyclo[3.2.1]octanylcarbamoylamino)-N,N-dimethylpyridine-3-carboxamide
PubChem CID138025945
Molecular FormulaC17H24N4O2
Molecular Weight316.41 g/mol
Exact Mass316.19
IUPAC Name6-(3-bicyclo[3.2.1]octanylcarbamoylamino)-N,N-dimethylpyridine-3-carboxamide
SMILESCN(C)C(=O)c1ccc(NC(=O)NC2CC3CCC(C3)C2)nc1
InChIInChI=1S/C17H24N4O2/c1-21(2)16(22)13-5-6-15(18-10-13)20-17(23)19-14-8-11-3-4-12(7-11)9-14/h5-6,10-12,14H,3-4,7-9H2,1-2H3,(H2,18,19,20,23)
InChIKeyGFZANEXJQPBCBQ-UHFFFAOYSA-N
XLogP2.48
TPSA74.33 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.41
LogP ≤ 52.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 6-(3-bicyclo[3.2.1]octanylcarbamoylamino)-N,N-dimethylpyridine-3-carboxamide with MolForge

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Related Compounds

6-(cyclopropylcarbamoylamino)pyridine-3-carboxylic acid
CID 62697960
6-[1-(2-bicyclo[2.2.1]heptanyl)ethylamino]-N,N-dimethylpyridine-3-carboxamide
CID 79764561
6-(2,2-dimethylhydrazinyl)-N,N-dimethylpyridine-3-carboxamide
CID 83025620
6-[[cyclopropyl(pyridin-2-yl)methyl]carbamoylamino]-N,N-dimethylpyridine-3-carboxamide
CID 138025940
N,N-dimethyl-6-[(4-propan-2-ylcycloheptyl)amino]pyridine-3-carboxamide
CID 133479815
6-[(1,1-dioxothiolan-3-yl)amino]-N,N-dimethylpyridine-3-carboxamide
CID 78956287
4-(cyclopropylcarbamoylamino)-N,N-dimethylbenzamide
CID 47181034
6-[[(1R,2R)-2-aminocyclohexyl]amino]-N,N-dimethylpyridine-3-carboxamide
CID 102738868
6-(2-cyclopropylpropylamino)-N,N-dimethylpyridine-3-carboxamide
CID 115623811
N,N-dimethyl-6-[(1-propanoylpyrrolidin-3-yl)amino]pyridine-3-carboxamide
CID 133366737
1-(5-hydroxy-2-pyridinyl)-3-(oxolan-3-yl)urea
CID 175479949
6-[[1-(cyanomethyl)piperidin-4-yl]amino]-N,N-dimethylpyridine-3-carboxamide
CID 78956032

Frequently Asked Questions

What is the IUPAC name of 6-(3-bicyclo[3.2.1]octanylcarbamoylamino)-N,N-dimethylpyridine-3-carboxamide?
The IUPAC name of 6-(3-bicyclo[3.2.1]octanylcarbamoylamino)-N,N-dimethylpyridine-3-carboxamide (CID 138025945) is 6-(3-bicyclo[3.2.1]octanylcarbamoylamino)-N,N-dimethylpyridine-3-carboxamide.
What is the SMILES notation for 6-(3-bicyclo[3.2.1]octanylcarbamoylamino)-N,N-dimethylpyridine-3-carboxamide?
The canonical SMILES for 6-(3-bicyclo[3.2.1]octanylcarbamoylamino)-N,N-dimethylpyridine-3-carboxamide is CN(C)C(=O)c1ccc(NC(=O)NC2CC3CCC(C3)C2)nc1.
What is the InChIKey of 6-(3-bicyclo[3.2.1]octanylcarbamoylamino)-N,N-dimethylpyridine-3-carboxamide?
The InChIKey is GFZANEXJQPBCBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N4O2/c1-21(2)16(22)13-5-6-15(18-10-13)20-17(23)19-14-8-11-3-4-12(7-11)9-14/h5-6,10-12,14H,3-4,7-9H2,1-2H3,(H2,18,19,20,23).
What are the key properties of 6-(3-bicyclo[3.2.1]octanylcarbamoylamino)-N,N-dimethylpyridine-3-carboxamide?
6-(3-bicyclo[3.2.1]octanylcarbamoylamino)-N,N-dimethylpyridine-3-carboxamide has a molecular weight of 316.41 g/mol, XLogP of 2.48, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-bicyclo[3.2.1]octanylcarbamoylamino)-N,N-dimethylpyridine-3-carboxamide is sourced from PubChem (CID 138025945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).