(2-cyclohexylimino-1-pyridinyl)-pyridin-2-ylmethanone

C17H19N3O — CID 16626228

IUPAC(2-cyclohexylimino-1-pyridinyl)-pyridin-2-ylmethanone
SMILESO=C(c1ccccn1)n1cccc/c1=N\C1CCCCC1
InChIInChI=1S/C17H19N3O/c21-17(15-10-4-6-12-18-15)20-13-7-5-11-16(20)19-14-8-2-1-3-9-14/h4-7,10-14H,1-3,8-9H2/b19-16+
InChIKeyDQCDQNBKYAZICR-KNTRCKAVSA-N
MW281.36 g/mol
LogP2.81
Rot. Bonds2

About (2-cyclohexylimino-1-pyridinyl)-pyridin-2-ylmethanone

(2-cyclohexylimino-1-pyridinyl)-pyridin-2-ylmethanone (PubChem CID 16626228) has the molecular formula C17H19N3O and a molecular weight of 281.36 g/mol. Its IUPAC name is (2-cyclohexylimino-1-pyridinyl)-pyridin-2-ylmethanone.

Molecular Properties

Compound Name(2-cyclohexylimino-1-pyridinyl)-pyridin-2-ylmethanone
PubChem CID16626228
Molecular FormulaC17H19N3O
Molecular Weight281.36 g/mol
Exact Mass281.15
IUPAC Name(2-cyclohexylimino-1-pyridinyl)-pyridin-2-ylmethanone
SMILESO=C(c1ccccn1)n1cccc/c1=N\C1CCCCC1
InChIInChI=1S/C17H19N3O/c21-17(15-10-4-6-12-18-15)20-13-7-5-11-16(20)19-14-8-2-1-3-9-14/h4-7,10-14H,1-3,8-9H2/b19-16+
InChIKeyDQCDQNBKYAZICR-KNTRCKAVSA-N
XLogP2.81
TPSA47.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 52.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

(1-chloroisoquinolin-3-yl)-(2-cyclohexylimino-1-pyridinyl)methanone
CID 55668391
(2-cyclohexylimino-1-pyridinyl)-[5-(cyclopropylmethoxy)pyrazin-2-yl]methanone
CID 166188653
(2-cyclohexylimino-1-pyridinyl)-(2,4-difluorophenyl)methanone
CID 16626252
(E)-1-(2-cyclohexylimino-1-pyridinyl)-3-phenylprop-2-en-1-one
CID 16626234
2-(2-chlorophenyl)-1-(2-cyclohexylimino-1-pyridinyl)ethanone
CID 16626276
2-[3-(2-cyclohexylimino-1-pyridinyl)-3-oxopropyl]-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione
CID 51321233
1-(pyridine-2-carbonyl)azepane-2-carboxylic acid
CID 64559743
2-[2-(2-cyclohexylimino-1-pyridinyl)-2-oxoethyl]-4-methylphthalazin-1-one
CID 55533497
N-amino-N'-cycloheptylpyridine-2-carboximidamide
CID 61361948
[4-(piperidine-1-carbonyl)piperazin-1-yl]-pyridin-2-ylmethanone
CID 30346280
[2-(2-hydroxycyclopentyl)piperidin-1-yl]-pyridin-2-ylmethanone
CID 79545297
1-[1-(pyridine-2-carbonyl)pyrrolidin-2-yl]ethanone
CID 168983000

Frequently Asked Questions

What is the IUPAC name of (2-cyclohexylimino-1-pyridinyl)-pyridin-2-ylmethanone?
The IUPAC name of (2-cyclohexylimino-1-pyridinyl)-pyridin-2-ylmethanone (CID 16626228) is (2-cyclohexylimino-1-pyridinyl)-pyridin-2-ylmethanone.
What is the SMILES notation for (2-cyclohexylimino-1-pyridinyl)-pyridin-2-ylmethanone?
The canonical SMILES for (2-cyclohexylimino-1-pyridinyl)-pyridin-2-ylmethanone is O=C(c1ccccn1)n1cccc/c1=N\C1CCCCC1.
What is the InChIKey of (2-cyclohexylimino-1-pyridinyl)-pyridin-2-ylmethanone?
The InChIKey is DQCDQNBKYAZICR-KNTRCKAVSA-N. The full InChI is InChI=1S/C17H19N3O/c21-17(15-10-4-6-12-18-15)20-13-7-5-11-16(20)19-14-8-2-1-3-9-14/h4-7,10-14H,1-3,8-9H2/b19-16+.
What are the key properties of (2-cyclohexylimino-1-pyridinyl)-pyridin-2-ylmethanone?
(2-cyclohexylimino-1-pyridinyl)-pyridin-2-ylmethanone has a molecular weight of 281.36 g/mol, XLogP of 2.81, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-cyclohexylimino-1-pyridinyl)-pyridin-2-ylmethanone is sourced from PubChem (CID 16626228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).