4-(methoxyiminomethyl)-N,N-dipropylbenzamide

C15H22N2O2 — CID 102603410

IUPAC4-(methoxyiminomethyl)-N,N-dipropylbenzamide
SMILESCCCN(CCC)C(=O)c1ccc(C=NOC)cc1
InChIInChI=1S/C15H22N2O2/c1-4-10-17(11-5-2)15(18)14-8-6-13(7-9-14)12-16-19-3/h6-9,12H,4-5,10-11H2,1-3H3
InChIKeyIGTONMFHZFZPPZ-UHFFFAOYSA-N
MW262.35 g/mol
LogP2.93
Rot. Bonds7

About 4-(methoxyiminomethyl)-N,N-dipropylbenzamide

4-(methoxyiminomethyl)-N,N-dipropylbenzamide (PubChem CID 102603410) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is 4-(methoxyiminomethyl)-N,N-dipropylbenzamide.

Molecular Properties

Compound Name4-(methoxyiminomethyl)-N,N-dipropylbenzamide
PubChem CID102603410
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name4-(methoxyiminomethyl)-N,N-dipropylbenzamide
SMILESCCCN(CCC)C(=O)c1ccc(C=NOC)cc1
InChIInChI=1S/C15H22N2O2/c1-4-10-17(11-5-2)15(18)14-8-6-13(7-9-14)12-16-19-3/h6-9,12H,4-5,10-11H2,1-3H3
InChIKeyIGTONMFHZFZPPZ-UHFFFAOYSA-N
XLogP2.93
TPSA41.90 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 52.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

4-(methoxyiminomethyl)-N,N-bis(prop-2-enyl)benzamide
CID 102603422
4-[5-(4-methanehydrazonoylphenoxy)pentoxy]-N,N-dipropylbenzamide
CID 142639027
ethane;4-methyl-N,N-dipropylbenzamide
CID 143600655
N,N-diethyl-2-[[4-[(E)-methoxyiminomethyl]benzoyl]amino]benzamide
CID 86835481
N-[(2-hydroxycyclohexyl)methyl]-4-[(E)-methoxyiminomethyl]-N-methylbenzamide
CID 110003396
4-[(E)-methoxyiminomethyl]-N-(3-methylbutyl)benzamide
CID 47101423
4-[[(E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]amino]-N,N-dipropylbenzamide
CID 17196156
benzene;formaldehyde;4-methyl-N,N-dipropylbenzamide
CID 144812222
4-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]carbamothioylamino]-N,N-dipropylbenzamide
CID 17196495
4-formyl-N-hexyl-N-pentylbenzamide
CID 59994993
N-(3-aminopropyl)-4-methoxy-N-propylbenzamide
CID 43136604
4-[ethyl(propyl)carbamoyl]benzoic acid
CID 43452972

Frequently Asked Questions

What is the IUPAC name of 4-(methoxyiminomethyl)-N,N-dipropylbenzamide?
The IUPAC name of 4-(methoxyiminomethyl)-N,N-dipropylbenzamide (CID 102603410) is 4-(methoxyiminomethyl)-N,N-dipropylbenzamide.
What is the SMILES notation for 4-(methoxyiminomethyl)-N,N-dipropylbenzamide?
The canonical SMILES for 4-(methoxyiminomethyl)-N,N-dipropylbenzamide is CCCN(CCC)C(=O)c1ccc(C=NOC)cc1.
What is the InChIKey of 4-(methoxyiminomethyl)-N,N-dipropylbenzamide?
The InChIKey is IGTONMFHZFZPPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-4-10-17(11-5-2)15(18)14-8-6-13(7-9-14)12-16-19-3/h6-9,12H,4-5,10-11H2,1-3H3.
What are the key properties of 4-(methoxyiminomethyl)-N,N-dipropylbenzamide?
4-(methoxyiminomethyl)-N,N-dipropylbenzamide has a molecular weight of 262.35 g/mol, XLogP of 2.93, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(methoxyiminomethyl)-N,N-dipropylbenzamide is sourced from PubChem (CID 102603410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).