[4-(dimethylamino)piperidin-1-yl]-[5-(methylamino)-2-pyridinyl]methanone

C14H22N4O — CID 104640276

IUPAC[4-(dimethylamino)piperidin-1-yl]-[5-(methylamino)-2-pyridinyl]methanone
SMILESCNc1ccc(C(=O)N2CCC(N(C)C)CC2)nc1
InChIInChI=1S/C14H22N4O/c1-15-11-4-5-13(16-10-11)14(19)18-8-6-12(7-9-18)17(2)3/h4-5,10,12,15H,6-9H2,1-3H3
InChIKeyRWEWWZZNASDSOP-UHFFFAOYSA-N
MW262.36 g/mol
LogP1.29
Rot. Bonds3

About [4-(dimethylamino)piperidin-1-yl]-[5-(methylamino)-2-pyridinyl]methanone

[4-(dimethylamino)piperidin-1-yl]-[5-(methylamino)-2-pyridinyl]methanone (PubChem CID 104640276) has the molecular formula C14H22N4O and a molecular weight of 262.36 g/mol. Its IUPAC name is [4-(dimethylamino)piperidin-1-yl]-[5-(methylamino)-2-pyridinyl]methanone.

Molecular Properties

Compound Name[4-(dimethylamino)piperidin-1-yl]-[5-(methylamino)-2-pyridinyl]methanone
PubChem CID104640276
Molecular FormulaC14H22N4O
Molecular Weight262.36 g/mol
Exact Mass262.18
IUPAC Name[4-(dimethylamino)piperidin-1-yl]-[5-(methylamino)-2-pyridinyl]methanone
SMILESCNc1ccc(C(=O)N2CCC(N(C)C)CC2)nc1
InChIInChI=1S/C14H22N4O/c1-15-11-4-5-13(16-10-11)14(19)18-8-6-12(7-9-18)17(2)3/h4-5,10,12,15H,6-9H2,1-3H3
InChIKeyRWEWWZZNASDSOP-UHFFFAOYSA-N
XLogP1.29
TPSA48.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[3-(dimethylamino)piperidin-1-yl]-[5-(methylamino)-2-pyridinyl]methanone
CID 104641657
[5-(methylamino)-2-pyridinyl]-(4-methylazepan-1-yl)methanone
CID 113436179
[4-(cyclopropylmethyl)piperazin-1-yl]-[5-(methylamino)-2-pyridinyl]methanone
CID 104641069
6-[4-(dimethylamino)piperidine-1-carbonyl]pyridine-3-carbonitrile
CID 63719374
3-azaspiro[5.5]undecan-3-yl-[5-(methylamino)-2-pyridinyl]methanone
CID 104641203
[5-(methylamino)-2-pyridinyl]-(1,4-oxazepan-4-yl)methanone
CID 113436167
2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl-[5-(methylamino)-2-pyridinyl]methanone
CID 104641595
[5-(methylamino)-2-pyridinyl]-[3-(trifluoromethyl)piperidin-1-yl]methanone
CID 104641627
[5-(methylamino)-2-pyridinyl]-(2,2,6,6-tetramethylmorpholin-4-yl)methanone
CID 102745621
[4-(dimethylamino)piperidin-1-yl]-(4-hydrazinyl-2-pyridinyl)methanone
CID 62243583
(3-ethyl-4-methylpiperazin-1-yl)-[5-(methylamino)-2-pyridinyl]methanone
CID 104641352
[2-(hydroxymethyl)morpholin-4-yl]-[5-(methylamino)-2-pyridinyl]methanone
CID 113436230

Frequently Asked Questions

What is the IUPAC name of [4-(dimethylamino)piperidin-1-yl]-[5-(methylamino)-2-pyridinyl]methanone?
The IUPAC name of [4-(dimethylamino)piperidin-1-yl]-[5-(methylamino)-2-pyridinyl]methanone (CID 104640276) is [4-(dimethylamino)piperidin-1-yl]-[5-(methylamino)-2-pyridinyl]methanone.
What is the SMILES notation for [4-(dimethylamino)piperidin-1-yl]-[5-(methylamino)-2-pyridinyl]methanone?
The canonical SMILES for [4-(dimethylamino)piperidin-1-yl]-[5-(methylamino)-2-pyridinyl]methanone is CNc1ccc(C(=O)N2CCC(N(C)C)CC2)nc1.
What is the InChIKey of [4-(dimethylamino)piperidin-1-yl]-[5-(methylamino)-2-pyridinyl]methanone?
The InChIKey is RWEWWZZNASDSOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O/c1-15-11-4-5-13(16-10-11)14(19)18-8-6-12(7-9-18)17(2)3/h4-5,10,12,15H,6-9H2,1-3H3.
What are the key properties of [4-(dimethylamino)piperidin-1-yl]-[5-(methylamino)-2-pyridinyl]methanone?
[4-(dimethylamino)piperidin-1-yl]-[5-(methylamino)-2-pyridinyl]methanone has a molecular weight of 262.36 g/mol, XLogP of 1.29, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(dimethylamino)piperidin-1-yl]-[5-(methylamino)-2-pyridinyl]methanone is sourced from PubChem (CID 104640276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).