N-[5-(pyridin-4-ylmethylamino)-2-pyridinyl]cyclopropanecarboxamide

C15H16N4O — CID 113027861

IUPACN-[5-(pyridin-4-ylmethylamino)-2-pyridinyl]cyclopropanecarboxamide
SMILESO=C(Nc1ccc(NCc2ccncc2)cn1)C1CC1
InChIInChI=1S/C15H16N4O/c20-15(12-1-2-12)19-14-4-3-13(10-18-14)17-9-11-5-7-16-8-6-11/h3-8,10,12,17H,1-2,9H2,(H,18,19,20)
InChIKeyYKUVBSBOVBITIZ-UHFFFAOYSA-N
MW268.32 g/mol
LogP2.44
Rot. Bonds5

About N-[5-(pyridin-4-ylmethylamino)-2-pyridinyl]cyclopropanecarboxamide

N-[5-(pyridin-4-ylmethylamino)-2-pyridinyl]cyclopropanecarboxamide (PubChem CID 113027861) has the molecular formula C15H16N4O and a molecular weight of 268.32 g/mol. Its IUPAC name is N-[5-(pyridin-4-ylmethylamino)-2-pyridinyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[5-(pyridin-4-ylmethylamino)-2-pyridinyl]cyclopropanecarboxamide
PubChem CID113027861
Molecular FormulaC15H16N4O
Molecular Weight268.32 g/mol
Exact Mass268.13
IUPAC NameN-[5-(pyridin-4-ylmethylamino)-2-pyridinyl]cyclopropanecarboxamide
SMILESO=C(Nc1ccc(NCc2ccncc2)cn1)C1CC1
InChIInChI=1S/C15H16N4O/c20-15(12-1-2-12)19-14-4-3-13(10-18-14)17-9-11-5-7-16-8-6-11/h3-8,10,12,17H,1-2,9H2,(H,18,19,20)
InChIKeyYKUVBSBOVBITIZ-UHFFFAOYSA-N
XLogP2.44
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 52.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[5-(pyridin-4-ylmethylamino)-2-pyridinyl]cyclohexanecarboxamide
CID 113027864
N-[4-(pyridin-4-ylmethylamino)phenyl]cyclopropanecarboxamide
CID 28660347
N-[5-(pyridin-4-ylmethylamino)-2-pyridinyl]butanamide
CID 113027859
4-amino-N-[5-(pyridin-4-ylmethylamino)-2-pyridinyl]butanamide
CID 39187538
N-[5-[(2-chlorophenyl)methylamino]-2-pyridinyl]cyclopropanecarboxamide
CID 113027169
N-[5-(cyclopropylamino)-2-pyridinyl]cyclopropanecarboxamide
CID 113023685
N-[6-[(4-fluorophenyl)methylamino]-3-pyridinyl]cyclohexanecarboxamide
CID 113012101
3,4-dimethyl-N-[5-(pyridin-4-ylmethylamino)-2-pyridinyl]benzamide
CID 113027886
N-[6-(cyclopropanecarbonylamino)-3-pyridinyl]pyrazine-2-carboxamide
CID 1452900
1-phenyl-3-[6-(pyridin-4-ylmethylamino)-3-pyridinyl]urea
CID 113012942
N-[5-[(2-methylphenyl)methylamino]-2-pyridinyl]cyclobutanecarboxamide
CID 113026538
N-[6-(propylamino)-3-pyridinyl]cyclopropanecarboxamide
CID 113009028

Frequently Asked Questions

What is the IUPAC name of N-[5-(pyridin-4-ylmethylamino)-2-pyridinyl]cyclopropanecarboxamide?
The IUPAC name of N-[5-(pyridin-4-ylmethylamino)-2-pyridinyl]cyclopropanecarboxamide (CID 113027861) is N-[5-(pyridin-4-ylmethylamino)-2-pyridinyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[5-(pyridin-4-ylmethylamino)-2-pyridinyl]cyclopropanecarboxamide?
The canonical SMILES for N-[5-(pyridin-4-ylmethylamino)-2-pyridinyl]cyclopropanecarboxamide is O=C(Nc1ccc(NCc2ccncc2)cn1)C1CC1.
What is the InChIKey of N-[5-(pyridin-4-ylmethylamino)-2-pyridinyl]cyclopropanecarboxamide?
The InChIKey is YKUVBSBOVBITIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4O/c20-15(12-1-2-12)19-14-4-3-13(10-18-14)17-9-11-5-7-16-8-6-11/h3-8,10,12,17H,1-2,9H2,(H,18,19,20).
What are the key properties of N-[5-(pyridin-4-ylmethylamino)-2-pyridinyl]cyclopropanecarboxamide?
N-[5-(pyridin-4-ylmethylamino)-2-pyridinyl]cyclopropanecarboxamide has a molecular weight of 268.32 g/mol, XLogP of 2.44, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(pyridin-4-ylmethylamino)-2-pyridinyl]cyclopropanecarboxamide is sourced from PubChem (CID 113027861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).