N-[6-(pentanoylamino)-3-pyridinyl]cyclopropanecarboxamide

C14H19N3O2 — CID 656369

IUPACN-[6-(pentanoylamino)-3-pyridinyl]cyclopropanecarboxamide
SMILESCCCCC(=O)Nc1ccc(NC(=O)C2CC2)cn1
InChIInChI=1S/C14H19N3O2/c1-2-3-4-13(18)17-12-8-7-11(9-15-12)16-14(19)10-5-6-10/h7-10H,2-6H2,1H3,(H,16,19)(H,15,17,18)
InChIKeyCXENRGKPPHRZSC-UHFFFAOYSA-N
MW261.32 g/mol
LogP2.56
Rot. Bonds6

About N-[6-(pentanoylamino)-3-pyridinyl]cyclopropanecarboxamide

N-[6-(pentanoylamino)-3-pyridinyl]cyclopropanecarboxamide (PubChem CID 656369) has the molecular formula C14H19N3O2 and a molecular weight of 261.32 g/mol. Its IUPAC name is N-[6-(pentanoylamino)-3-pyridinyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[6-(pentanoylamino)-3-pyridinyl]cyclopropanecarboxamide
PubChem CID656369
Molecular FormulaC14H19N3O2
Molecular Weight261.32 g/mol
Exact Mass261.15
IUPAC NameN-[6-(pentanoylamino)-3-pyridinyl]cyclopropanecarboxamide
SMILESCCCCC(=O)Nc1ccc(NC(=O)C2CC2)cn1
InChIInChI=1S/C14H19N3O2/c1-2-3-4-13(18)17-12-8-7-11(9-15-12)16-14(19)10-5-6-10/h7-10H,2-6H2,1H3,(H,16,19)(H,15,17,18)
InChIKeyCXENRGKPPHRZSC-UHFFFAOYSA-N
XLogP2.56
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 52.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[6-(pentanoylamino)-3-pyridinyl]cyclopropanecarboxamide?
The IUPAC name of N-[6-(pentanoylamino)-3-pyridinyl]cyclopropanecarboxamide (CID 656369) is N-[6-(pentanoylamino)-3-pyridinyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[6-(pentanoylamino)-3-pyridinyl]cyclopropanecarboxamide?
The canonical SMILES for N-[6-(pentanoylamino)-3-pyridinyl]cyclopropanecarboxamide is CCCCC(=O)Nc1ccc(NC(=O)C2CC2)cn1.
What is the InChIKey of N-[6-(pentanoylamino)-3-pyridinyl]cyclopropanecarboxamide?
The InChIKey is CXENRGKPPHRZSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O2/c1-2-3-4-13(18)17-12-8-7-11(9-15-12)16-14(19)10-5-6-10/h7-10H,2-6H2,1H3,(H,16,19)(H,15,17,18).
What are the key properties of N-[6-(pentanoylamino)-3-pyridinyl]cyclopropanecarboxamide?
N-[6-(pentanoylamino)-3-pyridinyl]cyclopropanecarboxamide has a molecular weight of 261.32 g/mol, XLogP of 2.56, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(pentanoylamino)-3-pyridinyl]cyclopropanecarboxamide is sourced from PubChem (CID 656369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).