(5-amino-2-methyl-3-pyridinyl)-[4-(dimethylamino)piperidin-1-yl]methanone

C14H22N4O — CID 54917256

IUPAC(5-amino-2-methyl-3-pyridinyl)-[4-(dimethylamino)piperidin-1-yl]methanone
SMILESCc1ncc(N)cc1C(=O)N1CCC(N(C)C)CC1
InChIInChI=1S/C14H22N4O/c1-10-13(8-11(15)9-16-10)14(19)18-6-4-12(5-7-18)17(2)3/h8-9,12H,4-7,15H2,1-3H3
InChIKeyKMJFFKSFNDPBNJ-UHFFFAOYSA-N
MW262.36 g/mol
LogP1.14
Rot. Bonds2

About (5-amino-2-methyl-3-pyridinyl)-[4-(dimethylamino)piperidin-1-yl]methanone

(5-amino-2-methyl-3-pyridinyl)-[4-(dimethylamino)piperidin-1-yl]methanone (PubChem CID 54917256) has the molecular formula C14H22N4O and a molecular weight of 262.36 g/mol. Its IUPAC name is (5-amino-2-methyl-3-pyridinyl)-[4-(dimethylamino)piperidin-1-yl]methanone.

Molecular Properties

Compound Name(5-amino-2-methyl-3-pyridinyl)-[4-(dimethylamino)piperidin-1-yl]methanone
PubChem CID54917256
Molecular FormulaC14H22N4O
Molecular Weight262.36 g/mol
Exact Mass262.18
IUPAC Name(5-amino-2-methyl-3-pyridinyl)-[4-(dimethylamino)piperidin-1-yl]methanone
SMILESCc1ncc(N)cc1C(=O)N1CCC(N(C)C)CC1
InChIInChI=1S/C14H22N4O/c1-10-13(8-11(15)9-16-10)14(19)18-6-4-12(5-7-18)17(2)3/h8-9,12H,4-7,15H2,1-3H3
InChIKeyKMJFFKSFNDPBNJ-UHFFFAOYSA-N
XLogP1.14
TPSA62.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 51.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(5-amino-2-methyl-3-pyridinyl)-(4-propan-2-ylpiperidin-1-yl)methanone
CID 103504927
(5-amino-2-methyl-3-pyridinyl)-[4-(1-hydroxyethyl)piperidin-1-yl]methanone
CID 106835086
1-[4-(5-amino-2-methylpyridine-3-carbonyl)piperazin-1-yl]-2-methylpropan-1-one
CID 61106837
(5-amino-2-methyl-3-pyridinyl)-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]methanone
CID 55127274
(5-amino-2-methyl-3-pyridinyl)-[4-(2-hydroxyethyl)piperazin-1-yl]methanone
CID 54917350
(5-amino-2-fluorophenyl)-[4-(dimethylamino)piperidin-1-yl]methanone
CID 43585610
(5-amino-2-methyl-3-pyridinyl)-(3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl)methanone
CID 63762866
(5-amino-2-methyl-3-pyridinyl)-(4-hydroxy-4-methylazepan-1-yl)methanone
CID 107403445
4-(5-amino-2-methylpyridine-3-carbonyl)-1-methylpiperazin-2-one
CID 64682126
1-(5-amino-2-methylpyridine-3-carbonyl)pyrrolidine-2-carboxamide
CID 54916812
(5-amino-2-methyl-3-pyridinyl)-[2-(hydroxymethyl)piperidin-1-yl]methanone
CID 61039382
(5-amino-2-methyl-3-pyridinyl)-(3,5-dihydro-2H-1,4-benzoxazepin-4-yl)methanone
CID 61218384

Frequently Asked Questions

What is the IUPAC name of (5-amino-2-methyl-3-pyridinyl)-[4-(dimethylamino)piperidin-1-yl]methanone?
The IUPAC name of (5-amino-2-methyl-3-pyridinyl)-[4-(dimethylamino)piperidin-1-yl]methanone (CID 54917256) is (5-amino-2-methyl-3-pyridinyl)-[4-(dimethylamino)piperidin-1-yl]methanone.
What is the SMILES notation for (5-amino-2-methyl-3-pyridinyl)-[4-(dimethylamino)piperidin-1-yl]methanone?
The canonical SMILES for (5-amino-2-methyl-3-pyridinyl)-[4-(dimethylamino)piperidin-1-yl]methanone is Cc1ncc(N)cc1C(=O)N1CCC(N(C)C)CC1.
What is the InChIKey of (5-amino-2-methyl-3-pyridinyl)-[4-(dimethylamino)piperidin-1-yl]methanone?
The InChIKey is KMJFFKSFNDPBNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O/c1-10-13(8-11(15)9-16-10)14(19)18-6-4-12(5-7-18)17(2)3/h8-9,12H,4-7,15H2,1-3H3.
What are the key properties of (5-amino-2-methyl-3-pyridinyl)-[4-(dimethylamino)piperidin-1-yl]methanone?
(5-amino-2-methyl-3-pyridinyl)-[4-(dimethylamino)piperidin-1-yl]methanone has a molecular weight of 262.36 g/mol, XLogP of 1.14, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5-amino-2-methyl-3-pyridinyl)-[4-(dimethylamino)piperidin-1-yl]methanone is sourced from PubChem (CID 54917256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).