piperidin-1-yl-[6-(propylamino)-2-pyridinyl]methanone

C14H21N3O — CID 62239787

IUPACpiperidin-1-yl-[6-(propylamino)-2-pyridinyl]methanone
SMILESCCCNc1cccc(C(=O)N2CCCCC2)n1
InChIInChI=1S/C14H21N3O/c1-2-9-15-13-8-6-7-12(16-13)14(18)17-10-4-3-5-11-17/h6-8H,2-5,9-11H2,1H3,(H,15,16)
InChIKeyRHTXIMRPCAATTF-UHFFFAOYSA-N
MW247.34 g/mol
LogP2.53
Rot. Bonds4

About piperidin-1-yl-[6-(propylamino)-2-pyridinyl]methanone

piperidin-1-yl-[6-(propylamino)-2-pyridinyl]methanone (PubChem CID 62239787) has the molecular formula C14H21N3O and a molecular weight of 247.34 g/mol. Its IUPAC name is piperidin-1-yl-[6-(propylamino)-2-pyridinyl]methanone.

Molecular Properties

Compound Namepiperidin-1-yl-[6-(propylamino)-2-pyridinyl]methanone
PubChem CID62239787
Molecular FormulaC14H21N3O
Molecular Weight247.34 g/mol
Exact Mass247.17
IUPAC Namepiperidin-1-yl-[6-(propylamino)-2-pyridinyl]methanone
SMILESCCCNc1cccc(C(=O)N2CCCCC2)n1
InChIInChI=1S/C14H21N3O/c1-2-9-15-13-8-6-7-12(16-13)14(18)17-10-4-3-5-11-17/h6-8H,2-5,9-11H2,1H3,(H,15,16)
InChIKeyRHTXIMRPCAATTF-UHFFFAOYSA-N
XLogP2.53
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(4-methyl-1,4-diazepan-1-yl)-[6-(propylamino)-2-pyridinyl]methanone
CID 62240932
1,4-oxazepan-4-yl-[6-(propylamino)-2-pyridinyl]methanone
CID 62966972
(4-methylpiperidin-1-yl)-[6-(propylamino)-2-pyridinyl]methanone
CID 62240105
(4-hydroxy-4-methylpiperidin-1-yl)-[6-(propylamino)-2-pyridinyl]methanone
CID 81109407
[6-(propylamino)-2-pyridinyl]-(4-propylpiperidin-1-yl)methanone
CID 62232698
(3,4-dimethylpyrrolidin-1-yl)-[6-(propylamino)-2-pyridinyl]methanone
CID 79180595
(4-ethoxypiperidin-1-yl)-[6-(propylamino)-2-pyridinyl]methanone
CID 62239996
[2-(hydroxymethyl)azepan-1-yl]-[6-(propylamino)-2-pyridinyl]methanone
CID 116637902
piperidin-1-yl-[6-(propylamino)pyridazin-3-yl]methanone
CID 55042849
azocan-1-yl-[6-(propan-2-ylamino)-2-pyridinyl]methanone
CID 115498168
piperidin-1-yl-[2-(propylamino)pyrimidin-4-yl]methanone
CID 109294729
azepan-1-yl-[2-(propylamino)pyrimidin-4-yl]methanone
CID 109294810

Frequently Asked Questions

What is the IUPAC name of piperidin-1-yl-[6-(propylamino)-2-pyridinyl]methanone?
The IUPAC name of piperidin-1-yl-[6-(propylamino)-2-pyridinyl]methanone (CID 62239787) is piperidin-1-yl-[6-(propylamino)-2-pyridinyl]methanone.
What is the SMILES notation for piperidin-1-yl-[6-(propylamino)-2-pyridinyl]methanone?
The canonical SMILES for piperidin-1-yl-[6-(propylamino)-2-pyridinyl]methanone is CCCNc1cccc(C(=O)N2CCCCC2)n1.
What is the InChIKey of piperidin-1-yl-[6-(propylamino)-2-pyridinyl]methanone?
The InChIKey is RHTXIMRPCAATTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O/c1-2-9-15-13-8-6-7-12(16-13)14(18)17-10-4-3-5-11-17/h6-8H,2-5,9-11H2,1H3,(H,15,16).
What are the key properties of piperidin-1-yl-[6-(propylamino)-2-pyridinyl]methanone?
piperidin-1-yl-[6-(propylamino)-2-pyridinyl]methanone has a molecular weight of 247.34 g/mol, XLogP of 2.53, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for piperidin-1-yl-[6-(propylamino)-2-pyridinyl]methanone is sourced from PubChem (CID 62239787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).