N,N-dimethyl-5-[3-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)piperidin-1-yl]sulfonylpyridin-2-amine

C19H27N5O2S — CID 126805656

IUPACN,N-dimethyl-5-[3-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)piperidin-1-yl]sulfonylpyridin-2-amine
SMILESCN(C)c1ccc(S(=O)(=O)N2CCCC(c3ncc4n3CCCC4)C2)cn1
InChIInChI=1S/C19H27N5O2S/c1-22(2)18-9-8-17(13-20-18)27(25,26)23-10-5-6-15(14-23)19-21-12-16-7-3-4-11-24(16)19/h8-9,12-13,15H,3-7,10-11,14H2,1-2H3
InChIKeyZJYBJPHDYSVQQK-UHFFFAOYSA-N
MW389.53 g/mol
LogP2.25
Rot. Bonds4

About N,N-dimethyl-5-[3-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)piperidin-1-yl]sulfonylpyridin-2-amine

N,N-dimethyl-5-[3-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)piperidin-1-yl]sulfonylpyridin-2-amine (PubChem CID 126805656) has the molecular formula C19H27N5O2S and a molecular weight of 389.53 g/mol. Its IUPAC name is N,N-dimethyl-5-[3-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)piperidin-1-yl]sulfonylpyridin-2-amine.

Molecular Properties

Compound NameN,N-dimethyl-5-[3-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)piperidin-1-yl]sulfonylpyridin-2-amine
PubChem CID126805656
Molecular FormulaC19H27N5O2S
Molecular Weight389.53 g/mol
Exact Mass389.19
IUPAC NameN,N-dimethyl-5-[3-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)piperidin-1-yl]sulfonylpyridin-2-amine
SMILESCN(C)c1ccc(S(=O)(=O)N2CCCC(c3ncc4n3CCCC4)C2)cn1
InChIInChI=1S/C19H27N5O2S/c1-22(2)18-9-8-17(13-20-18)27(25,26)23-10-5-6-15(14-23)19-21-12-16-7-3-4-11-24(16)19/h8-9,12-13,15H,3-7,10-11,14H2,1-2H3
InChIKeyZJYBJPHDYSVQQK-UHFFFAOYSA-N
XLogP2.25
TPSA71.33 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.53
LogP ≤ 52.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

N-methyl-N-(4-methylcyclohexyl)-5-pyrrolidin-1-ylsulfonylpyridin-2-amine
CID 78805459
3-[1-(5-pyrrolidin-1-ylsulfonyl-2-pyridinyl)piperidin-3-yl]-6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazole
CID 133292080
3-[(3R)-1-[4-(2-ethoxyethoxy)phenyl]sulfonylpiperidin-3-yl]-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepine
CID 97101028
3-[1-[4-(2-ethoxyethoxy)phenyl]sulfonylpiperidin-3-yl]-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepine
CID 71937129
N,N-dimethyl-5-(2,3,4,5-tetrahydro-1-benzazepin-1-ylsulfonyl)pyridin-2-amine
CID 100741484
N-methyl-N-[(1-methylpiperidin-4-yl)methyl]-5-pyrrolidin-1-ylsulfonylpyridin-2-amine
CID 133288130
[5-(1,3,4,5,7,8,9,9a-octahydropyrrolo[1,2-a][1,4]diazepin-2-ylsulfonyl)-2-pyridinyl]methanamine
CID 114613483
(2R)-2-ethoxy-1-[(3S)-3-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)piperidin-1-yl]propan-1-one
CID 124874961
N-methyl-5-pyrrolidin-1-ylsulfonyl-N-[[4-(trifluoromethyl)phenyl]methyl]pyridin-2-amine
CID 8892754
N-[(4-chlorophenyl)methyl]-N-methyl-5-piperidin-1-ylsulfonylpyridin-2-amine
CID 9195091
5-[3-(dimethylamino)piperidin-1-yl]sulfonylpyridine-2-carbonitrile
CID 115630482
N,N-dimethyl-4-(1-pyrrolidin-1-ylsulfonylpiperidin-3-yl)pyridin-2-amine
CID 110105853

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-5-[3-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)piperidin-1-yl]sulfonylpyridin-2-amine?
The IUPAC name of N,N-dimethyl-5-[3-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)piperidin-1-yl]sulfonylpyridin-2-amine (CID 126805656) is N,N-dimethyl-5-[3-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)piperidin-1-yl]sulfonylpyridin-2-amine.
What is the SMILES notation for N,N-dimethyl-5-[3-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)piperidin-1-yl]sulfonylpyridin-2-amine?
The canonical SMILES for N,N-dimethyl-5-[3-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)piperidin-1-yl]sulfonylpyridin-2-amine is CN(C)c1ccc(S(=O)(=O)N2CCCC(c3ncc4n3CCCC4)C2)cn1.
What is the InChIKey of N,N-dimethyl-5-[3-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)piperidin-1-yl]sulfonylpyridin-2-amine?
The InChIKey is ZJYBJPHDYSVQQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27N5O2S/c1-22(2)18-9-8-17(13-20-18)27(25,26)23-10-5-6-15(14-23)19-21-12-16-7-3-4-11-24(16)19/h8-9,12-13,15H,3-7,10-11,14H2,1-2H3.
What are the key properties of N,N-dimethyl-5-[3-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)piperidin-1-yl]sulfonylpyridin-2-amine?
N,N-dimethyl-5-[3-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)piperidin-1-yl]sulfonylpyridin-2-amine has a molecular weight of 389.53 g/mol, XLogP of 2.25, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-5-[3-(5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)piperidin-1-yl]sulfonylpyridin-2-amine is sourced from PubChem (CID 126805656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).