5-(cyclohexylamino)-N-phenylpyridine-2-carboxamide

C18H21N3O — CID 109183141

IUPAC5-(cyclohexylamino)-N-phenylpyridine-2-carboxamide
SMILESO=C(Nc1ccccc1)c1ccc(NC2CCCCC2)cn1
InChIInChI=1S/C18H21N3O/c22-18(21-15-9-5-2-6-10-15)17-12-11-16(13-19-17)20-14-7-3-1-4-8-14/h2,5-6,9-14,20H,1,3-4,7-8H2,(H,21,22)
InChIKeyCVXWPINGHSHKPD-UHFFFAOYSA-N
MW295.39 g/mol
LogP4.08
Rot. Bonds4

About 5-(cyclohexylamino)-N-phenylpyridine-2-carboxamide

5-(cyclohexylamino)-N-phenylpyridine-2-carboxamide (PubChem CID 109183141) has the molecular formula C18H21N3O and a molecular weight of 295.39 g/mol. Its IUPAC name is 5-(cyclohexylamino)-N-phenylpyridine-2-carboxamide.

Molecular Properties

Compound Name5-(cyclohexylamino)-N-phenylpyridine-2-carboxamide
PubChem CID109183141
Molecular FormulaC18H21N3O
Molecular Weight295.39 g/mol
Exact Mass295.17
IUPAC Name5-(cyclohexylamino)-N-phenylpyridine-2-carboxamide
SMILESO=C(Nc1ccccc1)c1ccc(NC2CCCCC2)cn1
InChIInChI=1S/C18H21N3O/c22-18(21-15-9-5-2-6-10-15)17-12-11-16(13-19-17)20-14-7-3-1-4-8-14/h2,5-6,9-14,20H,1,3-4,7-8H2,(H,21,22)
InChIKeyCVXWPINGHSHKPD-UHFFFAOYSA-N
XLogP4.08
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.39
LogP ≤ 54.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(cyclohexylamino)-N-phenylpyridine-2-carboxamide?
The IUPAC name of 5-(cyclohexylamino)-N-phenylpyridine-2-carboxamide (CID 109183141) is 5-(cyclohexylamino)-N-phenylpyridine-2-carboxamide.
What is the SMILES notation for 5-(cyclohexylamino)-N-phenylpyridine-2-carboxamide?
The canonical SMILES for 5-(cyclohexylamino)-N-phenylpyridine-2-carboxamide is O=C(Nc1ccccc1)c1ccc(NC2CCCCC2)cn1.
What is the InChIKey of 5-(cyclohexylamino)-N-phenylpyridine-2-carboxamide?
The InChIKey is CVXWPINGHSHKPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3O/c22-18(21-15-9-5-2-6-10-15)17-12-11-16(13-19-17)20-14-7-3-1-4-8-14/h2,5-6,9-14,20H,1,3-4,7-8H2,(H,21,22).
What are the key properties of 5-(cyclohexylamino)-N-phenylpyridine-2-carboxamide?
5-(cyclohexylamino)-N-phenylpyridine-2-carboxamide has a molecular weight of 295.39 g/mol, XLogP of 4.08, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(cyclohexylamino)-N-phenylpyridine-2-carboxamide is sourced from PubChem (CID 109183141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).