2-anilino-N-[3-(cyclopropylmethoxy)propyl]benzamide

C20H24N2O2 — CID 25471927

IUPAC2-anilino-N-[3-(cyclopropylmethoxy)propyl]benzamide
SMILESO=C(NCCCOCC1CC1)c1ccccc1Nc1ccccc1
InChIInChI=1S/C20H24N2O2/c23-20(21-13-6-14-24-15-16-11-12-16)18-9-4-5-10-19(18)22-17-7-2-1-3-8-17/h1-5,7-10,16,22H,6,11-15H2,(H,21,23)
InChIKeyRCPHOOJTVCZKPK-UHFFFAOYSA-N
MW324.42 g/mol
LogP3.98
Rot. Bonds9

About 2-anilino-N-[3-(cyclopropylmethoxy)propyl]benzamide

2-anilino-N-[3-(cyclopropylmethoxy)propyl]benzamide (PubChem CID 25471927) has the molecular formula C20H24N2O2 and a molecular weight of 324.42 g/mol. Its IUPAC name is 2-anilino-N-[3-(cyclopropylmethoxy)propyl]benzamide.

Molecular Properties

Compound Name2-anilino-N-[3-(cyclopropylmethoxy)propyl]benzamide
PubChem CID25471927
Molecular FormulaC20H24N2O2
Molecular Weight324.42 g/mol
Exact Mass324.18
IUPAC Name2-anilino-N-[3-(cyclopropylmethoxy)propyl]benzamide
SMILESO=C(NCCCOCC1CC1)c1ccccc1Nc1ccccc1
InChIInChI=1S/C20H24N2O2/c23-20(21-13-6-14-24-15-16-11-12-16)18-9-4-5-10-19(18)22-17-7-2-1-3-8-17/h1-5,7-10,16,22H,6,11-15H2,(H,21,23)
InChIKeyRCPHOOJTVCZKPK-UHFFFAOYSA-N
XLogP3.98
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.42
LogP ≤ 53.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[3-(cyclopropylmethoxy)propyl]-2-[(4-fluorophenyl)sulfonylamino]benzamide
CID 29238978
2-anilino-N-(2-methoxyethyl)benzamide
CID 27659255
2-chloro-N-[3-[3-(cyclopropylmethoxy)propylamino]-3-oxopropyl]benzamide
CID 18168914
N-[3-(cyclopropylmethoxy)propyl]-1H-indole-4-carboxamide
CID 43583021
N-[3-(cyclopropylmethoxy)propyl]-2-hydroxy-3-nitrobenzamide
CID 103746319
N-[3-(cyclopropylmethoxy)propyl]-2,3,4-trimethoxybenzamide
CID 46613320
N-[3-(cyclopropylmethoxy)propyl]-2-phenylquinoline-4-carboxamide
CID 31850076
5-chloro-N-[3-(cyclopropylmethoxy)propyl]-2-fluorobenzamide
CID 60676397
5-amino-2-bromo-N-[3-(cyclopropylmethoxy)propyl]benzamide
CID 115297054
4-[[2-(cyclopropylmethoxy)benzoyl]amino]butanoic acid
CID 119170749
2-(methylamino)-N-[3-(oxolan-2-ylmethoxy)propyl]benzamide
CID 61378454
2-[3-(cyclopropylmethoxy)propylamino]-N-phenylacetamide
CID 103603851

Frequently Asked Questions

What is the IUPAC name of 2-anilino-N-[3-(cyclopropylmethoxy)propyl]benzamide?
The IUPAC name of 2-anilino-N-[3-(cyclopropylmethoxy)propyl]benzamide (CID 25471927) is 2-anilino-N-[3-(cyclopropylmethoxy)propyl]benzamide.
What is the SMILES notation for 2-anilino-N-[3-(cyclopropylmethoxy)propyl]benzamide?
The canonical SMILES for 2-anilino-N-[3-(cyclopropylmethoxy)propyl]benzamide is O=C(NCCCOCC1CC1)c1ccccc1Nc1ccccc1.
What is the InChIKey of 2-anilino-N-[3-(cyclopropylmethoxy)propyl]benzamide?
The InChIKey is RCPHOOJTVCZKPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O2/c23-20(21-13-6-14-24-15-16-11-12-16)18-9-4-5-10-19(18)22-17-7-2-1-3-8-17/h1-5,7-10,16,22H,6,11-15H2,(H,21,23).
What are the key properties of 2-anilino-N-[3-(cyclopropylmethoxy)propyl]benzamide?
2-anilino-N-[3-(cyclopropylmethoxy)propyl]benzamide has a molecular weight of 324.42 g/mol, XLogP of 3.98, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-anilino-N-[3-(cyclopropylmethoxy)propyl]benzamide is sourced from PubChem (CID 25471927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).