N-cyclohexyl-N-(5-methyl-2-pyridinyl)-4-[[(2R)-oxolan-2-yl]methoxy]benzamide

C24H30N2O3 — CID 97006494

IUPACN-cyclohexyl-N-(5-methyl-2-pyridinyl)-4-[[(2R)-oxolan-2-yl]methoxy]benzamide
SMILESCc1ccc(N(C(=O)c2ccc(OC[C@H]3CCCO3)cc2)C2CCCCC2)nc1
InChIInChI=1S/C24H30N2O3/c1-18-9-14-23(25-16-18)26(20-6-3-2-4-7-20)24(27)19-10-12-21(13-11-19)29-17-22-8-5-15-28-22/h9-14,16,20,22H,2-8,15,17H2,1H3/t22-/m1/s1
InChIKeyLYJIFUNRXZIOCP-JOCHJYFZSA-N
MW394.52 g/mol
LogP4.93
Rot. Bonds6

About N-cyclohexyl-N-(5-methyl-2-pyridinyl)-4-[[(2R)-oxolan-2-yl]methoxy]benzamide

N-cyclohexyl-N-(5-methyl-2-pyridinyl)-4-[[(2R)-oxolan-2-yl]methoxy]benzamide (PubChem CID 97006494) has the molecular formula C24H30N2O3 and a molecular weight of 394.52 g/mol. Its IUPAC name is N-cyclohexyl-N-(5-methyl-2-pyridinyl)-4-[[(2R)-oxolan-2-yl]methoxy]benzamide.

Molecular Properties

Compound NameN-cyclohexyl-N-(5-methyl-2-pyridinyl)-4-[[(2R)-oxolan-2-yl]methoxy]benzamide
PubChem CID97006494
Molecular FormulaC24H30N2O3
Molecular Weight394.52 g/mol
Exact Mass394.23
IUPAC NameN-cyclohexyl-N-(5-methyl-2-pyridinyl)-4-[[(2R)-oxolan-2-yl]methoxy]benzamide
SMILESCc1ccc(N(C(=O)c2ccc(OC[C@H]3CCCO3)cc2)C2CCCCC2)nc1
InChIInChI=1S/C24H30N2O3/c1-18-9-14-23(25-16-18)26(20-6-3-2-4-7-20)24(27)19-10-12-21(13-11-19)29-17-22-8-5-15-28-22/h9-14,16,20,22H,2-8,15,17H2,1H3/t22-/m1/s1
InChIKeyLYJIFUNRXZIOCP-JOCHJYFZSA-N
XLogP4.93
TPSA51.66 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.52
LogP ≤ 54.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-[6-(dimethylamino)-3-pyridinyl]-4-(oxolan-2-ylmethoxy)benzamide
CID 42932973
4-methyl-N-[4-(oxolan-2-ylmethoxy)phenyl]benzamide
CID 4957909
1-[4-(oxolan-2-ylmethoxy)phenyl]propan-1-one
CID 24702536
2-[methyl-[4-(oxolan-2-ylmethoxy)benzoyl]amino]propanoic acid
CID 119209049
4-[[(2R)-oxolan-2-yl]methoxy]benzamide
CID 2541314
N-cycloheptyl-4-[[(2R)-oxolan-2-yl]methoxy]benzamide
CID 2125237
N-ethyl-N-(2-methylprop-2-enyl)-4-(oxolan-2-ylmethoxy)benzamide
CID 78800219
(4-methoxycarbonylphenyl) 4-[[(2S)-oxolan-2-yl]methoxy]benzoate
CID 2677890
N-cyclopropyl-4-methyl-N-[[3-[[(2S)-oxolan-2-yl]methoxy]phenyl]methyl]benzamide
CID 26320335
N-(2-amino-2-oxoethyl)-4-(oxolan-2-ylmethoxy)-N-propan-2-ylbenzamide
CID 112794067
N-[(2-methyl-1,3-thiazol-5-yl)methyl]-4-(oxolan-2-ylmethoxy)benzamide
CID 86825645
5-cyano-N-cyclohexyl-2-methyl-N-(5-methyl-2-pyridinyl)furan-3-carboxamide
CID 154735869

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-N-(5-methyl-2-pyridinyl)-4-[[(2R)-oxolan-2-yl]methoxy]benzamide?
The IUPAC name of N-cyclohexyl-N-(5-methyl-2-pyridinyl)-4-[[(2R)-oxolan-2-yl]methoxy]benzamide (CID 97006494) is N-cyclohexyl-N-(5-methyl-2-pyridinyl)-4-[[(2R)-oxolan-2-yl]methoxy]benzamide.
What is the SMILES notation for N-cyclohexyl-N-(5-methyl-2-pyridinyl)-4-[[(2R)-oxolan-2-yl]methoxy]benzamide?
The canonical SMILES for N-cyclohexyl-N-(5-methyl-2-pyridinyl)-4-[[(2R)-oxolan-2-yl]methoxy]benzamide is Cc1ccc(N(C(=O)c2ccc(OC[C@H]3CCCO3)cc2)C2CCCCC2)nc1.
What is the InChIKey of N-cyclohexyl-N-(5-methyl-2-pyridinyl)-4-[[(2R)-oxolan-2-yl]methoxy]benzamide?
The InChIKey is LYJIFUNRXZIOCP-JOCHJYFZSA-N. The full InChI is InChI=1S/C24H30N2O3/c1-18-9-14-23(25-16-18)26(20-6-3-2-4-7-20)24(27)19-10-12-21(13-11-19)29-17-22-8-5-15-28-22/h9-14,16,20,22H,2-8,15,17H2,1H3/t22-/m1/s1.
What are the key properties of N-cyclohexyl-N-(5-methyl-2-pyridinyl)-4-[[(2R)-oxolan-2-yl]methoxy]benzamide?
N-cyclohexyl-N-(5-methyl-2-pyridinyl)-4-[[(2R)-oxolan-2-yl]methoxy]benzamide has a molecular weight of 394.52 g/mol, XLogP of 4.93, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N-(5-methyl-2-pyridinyl)-4-[[(2R)-oxolan-2-yl]methoxy]benzamide is sourced from PubChem (CID 97006494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).