N-[5-(cyclopropanecarbonylamino)-2-pyridinyl]benzamide

C16H15N3O2 — CID 1449624

IUPACN-[5-(cyclopropanecarbonylamino)-2-pyridinyl]benzamide
SMILESO=C(Nc1ccc(NC(=O)C2CC2)cn1)c1ccccc1
InChIInChI=1S/C16H15N3O2/c20-15(12-6-7-12)18-13-8-9-14(17-10-13)19-16(21)11-4-2-1-3-5-11/h1-5,8-10,12H,6-7H2,(H,18,20)(H,17,19,21)
InChIKeyQTKJZUCPWRIVPZ-UHFFFAOYSA-N
MW281.31 g/mol
LogP2.68
Rot. Bonds4

About N-[5-(cyclopropanecarbonylamino)-2-pyridinyl]benzamide

N-[5-(cyclopropanecarbonylamino)-2-pyridinyl]benzamide (PubChem CID 1449624) has the molecular formula C16H15N3O2 and a molecular weight of 281.31 g/mol. Its IUPAC name is N-[5-(cyclopropanecarbonylamino)-2-pyridinyl]benzamide.

Molecular Properties

Compound NameN-[5-(cyclopropanecarbonylamino)-2-pyridinyl]benzamide
PubChem CID1449624
Molecular FormulaC16H15N3O2
Molecular Weight281.31 g/mol
Exact Mass281.12
IUPAC NameN-[5-(cyclopropanecarbonylamino)-2-pyridinyl]benzamide
SMILESO=C(Nc1ccc(NC(=O)C2CC2)cn1)c1ccccc1
InChIInChI=1S/C16H15N3O2/c20-15(12-6-7-12)18-13-8-9-14(17-10-13)19-16(21)11-4-2-1-3-5-11/h1-5,8-10,12H,6-7H2,(H,18,20)(H,17,19,21)
InChIKeyQTKJZUCPWRIVPZ-UHFFFAOYSA-N
XLogP2.68
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.31
LogP ≤ 52.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[5-(cyclopropanecarbonylamino)-2-pyridinyl]benzamide?
The IUPAC name of N-[5-(cyclopropanecarbonylamino)-2-pyridinyl]benzamide (CID 1449624) is N-[5-(cyclopropanecarbonylamino)-2-pyridinyl]benzamide.
What is the SMILES notation for N-[5-(cyclopropanecarbonylamino)-2-pyridinyl]benzamide?
The canonical SMILES for N-[5-(cyclopropanecarbonylamino)-2-pyridinyl]benzamide is O=C(Nc1ccc(NC(=O)C2CC2)cn1)c1ccccc1.
What is the InChIKey of N-[5-(cyclopropanecarbonylamino)-2-pyridinyl]benzamide?
The InChIKey is QTKJZUCPWRIVPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O2/c20-15(12-6-7-12)18-13-8-9-14(17-10-13)19-16(21)11-4-2-1-3-5-11/h1-5,8-10,12H,6-7H2,(H,18,20)(H,17,19,21).
What are the key properties of N-[5-(cyclopropanecarbonylamino)-2-pyridinyl]benzamide?
N-[5-(cyclopropanecarbonylamino)-2-pyridinyl]benzamide has a molecular weight of 281.31 g/mol, XLogP of 2.68, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(cyclopropanecarbonylamino)-2-pyridinyl]benzamide is sourced from PubChem (CID 1449624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).