N-cyclopropyl-3-(1H-indol-3-yl)-N-[(4-methoxyphenyl)methyl]propanamide

C22H24N2O2 — CID 26378402

IUPACN-cyclopropyl-3-(1H-indol-3-yl)-N-[(4-methoxyphenyl)methyl]propanamide
SMILESCOc1ccc(CN(C(=O)CCc2c[nH]c3ccccc23)C2CC2)cc1
InChIInChI=1S/C22H24N2O2/c1-26-19-11-6-16(7-12-19)15-24(18-9-10-18)22(25)13-8-17-14-23-21-5-3-2-4-20(17)21/h2-7,11-12,14,18,23H,8-10,13,15H2,1H3
InChIKeyZYXHGCOPPFIMGV-UHFFFAOYSA-N
MW348.45 g/mol
LogP4.30
Rot. Bonds7

About N-cyclopropyl-3-(1H-indol-3-yl)-N-[(4-methoxyphenyl)methyl]propanamide

N-cyclopropyl-3-(1H-indol-3-yl)-N-[(4-methoxyphenyl)methyl]propanamide (PubChem CID 26378402) has the molecular formula C22H24N2O2 and a molecular weight of 348.45 g/mol. Its IUPAC name is N-cyclopropyl-3-(1H-indol-3-yl)-N-[(4-methoxyphenyl)methyl]propanamide.

Molecular Properties

Compound NameN-cyclopropyl-3-(1H-indol-3-yl)-N-[(4-methoxyphenyl)methyl]propanamide
PubChem CID26378402
Molecular FormulaC22H24N2O2
Molecular Weight348.45 g/mol
Exact Mass348.18
IUPAC NameN-cyclopropyl-3-(1H-indol-3-yl)-N-[(4-methoxyphenyl)methyl]propanamide
SMILESCOc1ccc(CN(C(=O)CCc2c[nH]c3ccccc23)C2CC2)cc1
InChIInChI=1S/C22H24N2O2/c1-26-19-11-6-16(7-12-19)15-24(18-9-10-18)22(25)13-8-17-14-23-21-5-3-2-4-20(17)21/h2-7,11-12,14,18,23H,8-10,13,15H2,1H3
InChIKeyZYXHGCOPPFIMGV-UHFFFAOYSA-N
XLogP4.30
TPSA45.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.45
LogP ≤ 54.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclopropyl-N-[2-[2-(1H-indol-3-yl)ethyl-[(4-methoxyphenyl)methyl]amino]-2-oxoethyl]-2-methylpropanamide
CID 42770552
N-cyclopropyl-N-[(2,5-dimethoxyphenyl)methyl]-2-(1H-indol-3-yl)acetamide
CID 33078129
3-amino-N-cyclopropyl-N-[(4-methoxyphenyl)methyl]propanamide
CID 39350832
N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-3-(4-oxo-3H-quinazolin-2-yl)propanamide
CID 137258780
2-[(1S,4R)-2-azabicyclo[2.2.1]heptan-2-yl]-N-[2-(1H-indol-3-yl)ethyl]-N-[(4-methoxyphenyl)methyl]acetamide
CID 131941167
N-cyclopropyl-N-[2-[(4-ethoxyphenyl)methyl-[2-(1H-indol-3-yl)ethyl]amino]-2-oxoethyl]hexanamide
CID 5237679
N-cyclopropyl-N-(1-ethylpiperidin-4-yl)-3-(1H-indol-3-yl)propanamide
CID 51093208
3-cyclopentyl-N-[2-[2-(1H-indol-3-yl)ethyl-[(4-methoxyphenyl)methyl]amino]-2-oxoethyl]-N-(2-methoxyethyl)propanamide
CID 24717878
N-cyclopropyl-N-[2-[(4-ethoxyphenyl)methyl-[2-(1H-indol-3-yl)ethyl]amino]-2-oxoethyl]-2-phenylacetamide
CID 3264309
3-(1H-indol-3-yl)-N-methyl-N-[(4-prop-2-enoxyphenyl)methyl]propanamide
CID 31180102
N-[(4-methoxyphenyl)methyl]-N-[1-(2-phenylethyl)piperidin-4-yl]butanamide
CID 164851926
3-(1H-indol-3-yl)-N-[(4-methoxyphenyl)methyl]propanethioamide
CID 89150467

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3-(1H-indol-3-yl)-N-[(4-methoxyphenyl)methyl]propanamide?
The IUPAC name of N-cyclopropyl-3-(1H-indol-3-yl)-N-[(4-methoxyphenyl)methyl]propanamide (CID 26378402) is N-cyclopropyl-3-(1H-indol-3-yl)-N-[(4-methoxyphenyl)methyl]propanamide.
What is the SMILES notation for N-cyclopropyl-3-(1H-indol-3-yl)-N-[(4-methoxyphenyl)methyl]propanamide?
The canonical SMILES for N-cyclopropyl-3-(1H-indol-3-yl)-N-[(4-methoxyphenyl)methyl]propanamide is COc1ccc(CN(C(=O)CCc2c[nH]c3ccccc23)C2CC2)cc1.
What is the InChIKey of N-cyclopropyl-3-(1H-indol-3-yl)-N-[(4-methoxyphenyl)methyl]propanamide?
The InChIKey is ZYXHGCOPPFIMGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N2O2/c1-26-19-11-6-16(7-12-19)15-24(18-9-10-18)22(25)13-8-17-14-23-21-5-3-2-4-20(17)21/h2-7,11-12,14,18,23H,8-10,13,15H2,1H3.
What are the key properties of N-cyclopropyl-3-(1H-indol-3-yl)-N-[(4-methoxyphenyl)methyl]propanamide?
N-cyclopropyl-3-(1H-indol-3-yl)-N-[(4-methoxyphenyl)methyl]propanamide has a molecular weight of 348.45 g/mol, XLogP of 4.30, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-(1H-indol-3-yl)-N-[(4-methoxyphenyl)methyl]propanamide is sourced from PubChem (CID 26378402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).