(2-cyclohexylimino-1-pyridinyl)-[5-(cyclopropylmethoxy)pyrazin-2-yl]methanone

C20H24N4O2 — CID 166188653

IUPAC(2-cyclohexylimino-1-pyridinyl)-[5-(cyclopropylmethoxy)pyrazin-2-yl]methanone
SMILESO=C(c1cnc(OCC2CC2)cn1)n1cccc/c1=N\C1CCCCC1
InChIInChI=1S/C20H24N4O2/c25-20(17-12-22-19(13-21-17)26-14-15-9-10-15)24-11-5-4-8-18(24)23-16-6-2-1-3-7-16/h4-5,8,11-13,15-16H,1-3,6-7,9-10,14H2/b23-18+
InChIKeyCPQFDUNSAYCMFS-PTGBLXJZSA-N
MW352.44 g/mol
LogP2.99
Rot. Bonds5

About (2-cyclohexylimino-1-pyridinyl)-[5-(cyclopropylmethoxy)pyrazin-2-yl]methanone

(2-cyclohexylimino-1-pyridinyl)-[5-(cyclopropylmethoxy)pyrazin-2-yl]methanone (PubChem CID 166188653) has the molecular formula C20H24N4O2 and a molecular weight of 352.44 g/mol. Its IUPAC name is (2-cyclohexylimino-1-pyridinyl)-[5-(cyclopropylmethoxy)pyrazin-2-yl]methanone.

Molecular Properties

Compound Name(2-cyclohexylimino-1-pyridinyl)-[5-(cyclopropylmethoxy)pyrazin-2-yl]methanone
PubChem CID166188653
Molecular FormulaC20H24N4O2
Molecular Weight352.44 g/mol
Exact Mass352.19
IUPAC Name(2-cyclohexylimino-1-pyridinyl)-[5-(cyclopropylmethoxy)pyrazin-2-yl]methanone
SMILESO=C(c1cnc(OCC2CC2)cn1)n1cccc/c1=N\C1CCCCC1
InChIInChI=1S/C20H24N4O2/c25-20(17-12-22-19(13-21-17)26-14-15-9-10-15)24-11-5-4-8-18(24)23-16-6-2-1-3-7-16/h4-5,8,11-13,15-16H,1-3,6-7,9-10,14H2/b23-18+
InChIKeyCPQFDUNSAYCMFS-PTGBLXJZSA-N
XLogP2.99
TPSA69.37 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.44
LogP ≤ 52.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

(2-cyclohexylimino-1-pyridinyl)-pyridin-2-ylmethanone
CID 16626228
(2-cyclohexylimino-1-pyridinyl)-(5-methylimidazo[1,2-a]pyridin-2-yl)methanone
CID 18273861
2-(2-chlorophenyl)-1-(2-cyclohexylimino-1-pyridinyl)ethanone
CID 16626276
(2-cyclohexylimino-1-pyridinyl)-[2-(difluoromethoxy)phenyl]methanone
CID 16626285
(2-cyclohexylimino-1-pyridinyl)-(2,4-difluorophenyl)methanone
CID 16626252
(2-chloro-4,5-difluorophenyl)-(2-cyclohexylimino-1-pyridinyl)methanone
CID 16626260
2-[2-(2-cyclohexylimino-1-pyridinyl)-2-oxoethyl]-4-methylphthalazin-1-one
CID 55533497
2-[3-(2-cyclohexylimino-1-pyridinyl)-3-oxopropyl]-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione
CID 51321233
4-[1-(2-cyclohexylimino-1-pyridinyl)-1-oxopropan-2-yl]oxybenzonitrile
CID 46684707
3-[3-(2-cyclohexylimino-1-pyridinyl)-3-oxopropyl]-5,6-dimethylthieno[2,3-d]pyrimidin-4-one
CID 43042644
1-(2-cyclohexylimino-1-pyridinyl)-2-(8-methylimidazo[1,2-a]pyridin-2-yl)ethanone
CID 86877064
N-[3-(2-cyclohexylimino-1-pyridinyl)-1-(4-methoxyphenyl)-3-oxopropyl]acetamide
CID 46696415

Frequently Asked Questions

What is the IUPAC name of (2-cyclohexylimino-1-pyridinyl)-[5-(cyclopropylmethoxy)pyrazin-2-yl]methanone?
The IUPAC name of (2-cyclohexylimino-1-pyridinyl)-[5-(cyclopropylmethoxy)pyrazin-2-yl]methanone (CID 166188653) is (2-cyclohexylimino-1-pyridinyl)-[5-(cyclopropylmethoxy)pyrazin-2-yl]methanone.
What is the SMILES notation for (2-cyclohexylimino-1-pyridinyl)-[5-(cyclopropylmethoxy)pyrazin-2-yl]methanone?
The canonical SMILES for (2-cyclohexylimino-1-pyridinyl)-[5-(cyclopropylmethoxy)pyrazin-2-yl]methanone is O=C(c1cnc(OCC2CC2)cn1)n1cccc/c1=N\C1CCCCC1.
What is the InChIKey of (2-cyclohexylimino-1-pyridinyl)-[5-(cyclopropylmethoxy)pyrazin-2-yl]methanone?
The InChIKey is CPQFDUNSAYCMFS-PTGBLXJZSA-N. The full InChI is InChI=1S/C20H24N4O2/c25-20(17-12-22-19(13-21-17)26-14-15-9-10-15)24-11-5-4-8-18(24)23-16-6-2-1-3-7-16/h4-5,8,11-13,15-16H,1-3,6-7,9-10,14H2/b23-18+.
What are the key properties of (2-cyclohexylimino-1-pyridinyl)-[5-(cyclopropylmethoxy)pyrazin-2-yl]methanone?
(2-cyclohexylimino-1-pyridinyl)-[5-(cyclopropylmethoxy)pyrazin-2-yl]methanone has a molecular weight of 352.44 g/mol, XLogP of 2.99, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2-cyclohexylimino-1-pyridinyl)-[5-(cyclopropylmethoxy)pyrazin-2-yl]methanone is sourced from PubChem (CID 166188653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).