N'-(cycloocten-1-yl)-4-(morpholin-4-ylmethyl)benzohydrazide

C20H29N3O2 — CID 3659350

IUPACN'-(cycloocten-1-yl)-4-(morpholin-4-ylmethyl)benzohydrazide
SMILESO=C(NNC1=CCCCCCC1)c1ccc(CN2CCOCC2)cc1
InChIInChI=1S/C20H29N3O2/c24-20(22-21-19-6-4-2-1-3-5-7-19)18-10-8-17(9-11-18)16-23-12-14-25-15-13-23/h6,8-11,21H,1-5,7,12-16H2,(H,22,24)
InChIKeyJCEIVRIVOJVXIG-UHFFFAOYSA-N
MW343.47 g/mol
LogP2.99
Rot. Bonds5

About N'-(cycloocten-1-yl)-4-(morpholin-4-ylmethyl)benzohydrazide

N'-(cycloocten-1-yl)-4-(morpholin-4-ylmethyl)benzohydrazide (PubChem CID 3659350) has the molecular formula C20H29N3O2 and a molecular weight of 343.47 g/mol. Its IUPAC name is N'-(cycloocten-1-yl)-4-(morpholin-4-ylmethyl)benzohydrazide.

Molecular Properties

Compound NameN'-(cycloocten-1-yl)-4-(morpholin-4-ylmethyl)benzohydrazide
PubChem CID3659350
Molecular FormulaC20H29N3O2
Molecular Weight343.47 g/mol
Exact Mass343.23
IUPAC NameN'-(cycloocten-1-yl)-4-(morpholin-4-ylmethyl)benzohydrazide
SMILESO=C(NNC1=CCCCCCC1)c1ccc(CN2CCOCC2)cc1
InChIInChI=1S/C20H29N3O2/c24-20(22-21-19-6-4-2-1-3-5-7-19)18-10-8-17(9-11-18)16-23-12-14-25-15-13-23/h6,8-11,21H,1-5,7,12-16H2,(H,22,24)
InChIKeyJCEIVRIVOJVXIG-UHFFFAOYSA-N
XLogP2.99
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.47
LogP ≤ 52.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-(cyclooctylideneamino)-4-(morpholin-4-ylmethyl)benzamide
CID 762046
4-(morpholin-4-ylmethyl)-N-[6-[[4-(morpholin-4-ylmethyl)benzoyl]amino]hexyl]benzamide
CID 2864244
N'-(cyclohexen-1-yl)-4-(phenylsulfanylmethyl)benzohydrazide
CID 3663481
N-(2-aminoethyl)-4-(morpholin-4-ylmethyl)benzamide
CID 84614014
N-(3-methylbutan-2-yl)-4-(morpholin-4-ylmethyl)benzamide
CID 133244954
(4-chlorophenyl)-[4-(morpholin-4-ylmethyl)phenyl]methanone
CID 24724233
CID 59303659
CID 59303659
N-benzyl-4-(morpholin-4-ylmethyl)benzamide
CID 786772
N-butan-2-yl-4-(morpholin-4-ylmethyl)benzamide
CID 2863525
methyl 4-(morpholin-4-ylmethyl)benzoate
CID 10466592
N-[4-(azepan-1-ylsulfonyl)phenyl]-4-(morpholin-4-ylmethyl)benzamide
CID 126320858
N-(4-acetylphenyl)-4-(morpholin-4-ylmethyl)benzamide
CID 5132306

Frequently Asked Questions

What is the IUPAC name of N'-(cycloocten-1-yl)-4-(morpholin-4-ylmethyl)benzohydrazide?
The IUPAC name of N'-(cycloocten-1-yl)-4-(morpholin-4-ylmethyl)benzohydrazide (CID 3659350) is N'-(cycloocten-1-yl)-4-(morpholin-4-ylmethyl)benzohydrazide.
What is the SMILES notation for N'-(cycloocten-1-yl)-4-(morpholin-4-ylmethyl)benzohydrazide?
The canonical SMILES for N'-(cycloocten-1-yl)-4-(morpholin-4-ylmethyl)benzohydrazide is O=C(NNC1=CCCCCCC1)c1ccc(CN2CCOCC2)cc1.
What is the InChIKey of N'-(cycloocten-1-yl)-4-(morpholin-4-ylmethyl)benzohydrazide?
The InChIKey is JCEIVRIVOJVXIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H29N3O2/c24-20(22-21-19-6-4-2-1-3-5-7-19)18-10-8-17(9-11-18)16-23-12-14-25-15-13-23/h6,8-11,21H,1-5,7,12-16H2,(H,22,24).
What are the key properties of N'-(cycloocten-1-yl)-4-(morpholin-4-ylmethyl)benzohydrazide?
N'-(cycloocten-1-yl)-4-(morpholin-4-ylmethyl)benzohydrazide has a molecular weight of 343.47 g/mol, XLogP of 2.99, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(cycloocten-1-yl)-4-(morpholin-4-ylmethyl)benzohydrazide is sourced from PubChem (CID 3659350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).