1-(4-amino-5-methyl-2-pyridinyl)piperidine-4-carboxamide

C12H18N4O — CID 83265690

IUPAC1-(4-amino-5-methyl-2-pyridinyl)piperidine-4-carboxamide
SMILESCc1cnc(N2CCC(C(N)=O)CC2)cc1N
InChIInChI=1S/C12H18N4O/c1-8-7-15-11(6-10(8)13)16-4-2-9(3-5-16)12(14)17/h6-7,9H,2-5H2,1H3,(H2,13,15)(H2,14,17)
InChIKeyONHCWVWIHUHICN-UHFFFAOYSA-N
MW234.30 g/mol
LogP0.67
Rot. Bonds2

About 1-(4-amino-5-methyl-2-pyridinyl)piperidine-4-carboxamide

1-(4-amino-5-methyl-2-pyridinyl)piperidine-4-carboxamide (PubChem CID 83265690) has the molecular formula C12H18N4O and a molecular weight of 234.30 g/mol. Its IUPAC name is 1-(4-amino-5-methyl-2-pyridinyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(4-amino-5-methyl-2-pyridinyl)piperidine-4-carboxamide
PubChem CID83265690
Molecular FormulaC12H18N4O
Molecular Weight234.30 g/mol
Exact Mass234.15
IUPAC Name1-(4-amino-5-methyl-2-pyridinyl)piperidine-4-carboxamide
SMILESCc1cnc(N2CCC(C(N)=O)CC2)cc1N
InChIInChI=1S/C12H18N4O/c1-8-7-15-11(6-10(8)13)16-4-2-9(3-5-16)12(14)17/h6-7,9H,2-5H2,1H3,(H2,13,15)(H2,14,17)
InChIKeyONHCWVWIHUHICN-UHFFFAOYSA-N
XLogP0.67
TPSA85.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 50.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(4-amino-5-methyl-2-pyridinyl)piperidine-4-carboxamide?
The IUPAC name of 1-(4-amino-5-methyl-2-pyridinyl)piperidine-4-carboxamide (CID 83265690) is 1-(4-amino-5-methyl-2-pyridinyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(4-amino-5-methyl-2-pyridinyl)piperidine-4-carboxamide?
The canonical SMILES for 1-(4-amino-5-methyl-2-pyridinyl)piperidine-4-carboxamide is Cc1cnc(N2CCC(C(N)=O)CC2)cc1N.
What is the InChIKey of 1-(4-amino-5-methyl-2-pyridinyl)piperidine-4-carboxamide?
The InChIKey is ONHCWVWIHUHICN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4O/c1-8-7-15-11(6-10(8)13)16-4-2-9(3-5-16)12(14)17/h6-7,9H,2-5H2,1H3,(H2,13,15)(H2,14,17).
What are the key properties of 1-(4-amino-5-methyl-2-pyridinyl)piperidine-4-carboxamide?
1-(4-amino-5-methyl-2-pyridinyl)piperidine-4-carboxamide has a molecular weight of 234.30 g/mol, XLogP of 0.67, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-amino-5-methyl-2-pyridinyl)piperidine-4-carboxamide is sourced from PubChem (CID 83265690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).