4-(cyclopropylmethoxy)-N-[4-(dimethylamino)-3-methylphenyl]benzamide

C20H24N2O2 — CID 60571631

IUPAC4-(cyclopropylmethoxy)-N-[4-(dimethylamino)-3-methylphenyl]benzamide
SMILESCc1cc(NC(=O)c2ccc(OCC3CC3)cc2)ccc1N(C)C
InChIInChI=1S/C20H24N2O2/c1-14-12-17(8-11-19(14)22(2)3)21-20(23)16-6-9-18(10-7-16)24-13-15-4-5-15/h6-12,15H,4-5,13H2,1-3H3,(H,21,23)
InChIKeyVOILQHPKGRFZEM-UHFFFAOYSA-N
MW324.42 g/mol
LogP4.10
Rot. Bonds6

About 4-(cyclopropylmethoxy)-N-[4-(dimethylamino)-3-methylphenyl]benzamide

4-(cyclopropylmethoxy)-N-[4-(dimethylamino)-3-methylphenyl]benzamide (PubChem CID 60571631) has the molecular formula C20H24N2O2 and a molecular weight of 324.42 g/mol. Its IUPAC name is 4-(cyclopropylmethoxy)-N-[4-(dimethylamino)-3-methylphenyl]benzamide.

Molecular Properties

Compound Name4-(cyclopropylmethoxy)-N-[4-(dimethylamino)-3-methylphenyl]benzamide
PubChem CID60571631
Molecular FormulaC20H24N2O2
Molecular Weight324.42 g/mol
Exact Mass324.18
IUPAC Name4-(cyclopropylmethoxy)-N-[4-(dimethylamino)-3-methylphenyl]benzamide
SMILESCc1cc(NC(=O)c2ccc(OCC3CC3)cc2)ccc1N(C)C
InChIInChI=1S/C20H24N2O2/c1-14-12-17(8-11-19(14)22(2)3)21-20(23)16-6-9-18(10-7-16)24-13-15-4-5-15/h6-12,15H,4-5,13H2,1-3H3,(H,21,23)
InChIKeyVOILQHPKGRFZEM-UHFFFAOYSA-N
XLogP4.10
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.42
LogP ≤ 54.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

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Related Compounds

4-(cyclopropylmethoxy)-N-[4-[3-(dimethylamino)propoxy]phenyl]benzamide
CID 86898305
4-[[4-(cyclopropylmethoxy)benzoyl]amino]benzamide
CID 60571619
4-(cyclopropylmethoxy)-N-[6-(hydroxymethyl)naphthalen-2-yl]benzamide
CID 58111737
4-(aminomethyl)-N-[4-(cyclopropylmethoxy)phenyl]benzamide
CID 119325256
N-(3,4-dimethylphenyl)-4-[[(2S)-oxolan-2-yl]methoxy]benzamide
CID 42580258
4-(cyclopropylmethoxy)-N-(6-formyl-5-methyl-7,8-dihydronaphthalen-2-yl)benzamide
CID 58111716
4-[(carbamoylamino)methyl]-N-[4-(cyclopropylmethoxy)phenyl]benzamide
CID 75371278
4-(cyclopropylmethoxy)-N-ethylbenzamide
CID 60572461
N-[4-(dimethylamino)-3-methylphenyl]-2-(4-iodophenoxy)acetamide
CID 55652450
2-[4-[[4-(cyclopropylmethoxy)phenyl]carbamoyl]-2-ethoxyphenoxy]acetic acid
CID 119185306
4-(cyclopropylmethoxy)benzoic acid;methyl 5-[[4-(cyclopropylmethoxy)benzoyl]amino]-1,3-dimethylindole-2-carboxylate
CID 161058773
1-[4-(dimethylamino)-3-methylphenyl]-3-[(3-hydroxycyclohexyl)methyl]urea
CID 111473697

Frequently Asked Questions

What is the IUPAC name of 4-(cyclopropylmethoxy)-N-[4-(dimethylamino)-3-methylphenyl]benzamide?
The IUPAC name of 4-(cyclopropylmethoxy)-N-[4-(dimethylamino)-3-methylphenyl]benzamide (CID 60571631) is 4-(cyclopropylmethoxy)-N-[4-(dimethylamino)-3-methylphenyl]benzamide.
What is the SMILES notation for 4-(cyclopropylmethoxy)-N-[4-(dimethylamino)-3-methylphenyl]benzamide?
The canonical SMILES for 4-(cyclopropylmethoxy)-N-[4-(dimethylamino)-3-methylphenyl]benzamide is Cc1cc(NC(=O)c2ccc(OCC3CC3)cc2)ccc1N(C)C.
What is the InChIKey of 4-(cyclopropylmethoxy)-N-[4-(dimethylamino)-3-methylphenyl]benzamide?
The InChIKey is VOILQHPKGRFZEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O2/c1-14-12-17(8-11-19(14)22(2)3)21-20(23)16-6-9-18(10-7-16)24-13-15-4-5-15/h6-12,15H,4-5,13H2,1-3H3,(H,21,23).
What are the key properties of 4-(cyclopropylmethoxy)-N-[4-(dimethylamino)-3-methylphenyl]benzamide?
4-(cyclopropylmethoxy)-N-[4-(dimethylamino)-3-methylphenyl]benzamide has a molecular weight of 324.42 g/mol, XLogP of 4.10, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(cyclopropylmethoxy)-N-[4-(dimethylamino)-3-methylphenyl]benzamide is sourced from PubChem (CID 60571631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).