4-methoxy-1-methyl-N-[(1-propylpiperidin-4-yl)methyl]indole-2-carboxamide

C20H29N3O2 — CID 46964195

IUPAC4-methoxy-1-methyl-N-[(1-propylpiperidin-4-yl)methyl]indole-2-carboxamide
SMILESCCCN1CCC(CNC(=O)c2cc3c(OC)cccc3n2C)CC1
InChIInChI=1S/C20H29N3O2/c1-4-10-23-11-8-15(9-12-23)14-21-20(24)18-13-16-17(22(18)2)6-5-7-19(16)25-3/h5-7,13,15H,4,8-12,14H2,1-3H3,(H,21,24)
InChIKeyLNXJZVUROMEHCL-UHFFFAOYSA-N
MW343.47 g/mol
LogP3.04
Rot. Bonds6

About 4-methoxy-1-methyl-N-[(1-propylpiperidin-4-yl)methyl]indole-2-carboxamide

4-methoxy-1-methyl-N-[(1-propylpiperidin-4-yl)methyl]indole-2-carboxamide (PubChem CID 46964195) has the molecular formula C20H29N3O2 and a molecular weight of 343.47 g/mol. Its IUPAC name is 4-methoxy-1-methyl-N-[(1-propylpiperidin-4-yl)methyl]indole-2-carboxamide.

Molecular Properties

Compound Name4-methoxy-1-methyl-N-[(1-propylpiperidin-4-yl)methyl]indole-2-carboxamide
PubChem CID46964195
Molecular FormulaC20H29N3O2
Molecular Weight343.47 g/mol
Exact Mass343.23
IUPAC Name4-methoxy-1-methyl-N-[(1-propylpiperidin-4-yl)methyl]indole-2-carboxamide
SMILESCCCN1CCC(CNC(=O)c2cc3c(OC)cccc3n2C)CC1
InChIInChI=1S/C20H29N3O2/c1-4-10-23-11-8-15(9-12-23)14-21-20(24)18-13-16-17(22(18)2)6-5-7-19(16)25-3/h5-7,13,15H,4,8-12,14H2,1-3H3,(H,21,24)
InChIKeyLNXJZVUROMEHCL-UHFFFAOYSA-N
XLogP3.04
TPSA46.50 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.47
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3,4,5-trimethoxy-N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]benzamide
CID 16895501
1-(difluoromethyl)-5-methyl-N-[(1-propylpiperidin-4-yl)methyl]pyrrole-2-carboxamide
CID 118779571
5-methoxy-1-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]indole-2-carboxamide
CID 56721773
N-[[1-[(2,2-dimethyl-3H-1-benzofuran-7-yl)methyl]piperidin-4-yl]methyl]-1-methylindole-2-carboxamide
CID 25056650
1-ethyl-3-[(1-propylpiperidin-4-yl)methyl]-2-[(3,4,5-trimethoxyphenyl)methyl]guanidine
CID 111377296
1-[(3,4-dimethoxyphenyl)methyl]-3-[(1-propylpyrrolidin-3-yl)methyl]urea
CID 60568343
4-amino-5-chloro-2-methoxy-N-[[1-[6-oxo-6-(1-propylindol-3-yl)hexyl]piperidin-4-yl]methyl]benzamide
CID 54560381
N-[(2,3-dimethoxyphenyl)methyl]-1-propylpiperidin-4-amine
CID 28718160
N-[[(1R,9aR)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]methyl]-4-chloro-1-methylindole-2-carboxamide
CID 125338467
N-[(1-ethylpiperidin-4-yl)methyl]-2-(2-methoxyphenoxy)acetamide
CID 51092761
(2,3-dimethoxyphenyl)-[4-(ethylaminomethyl)piperidin-1-yl]methanone
CID 119647989
1,4-dimethyl-N-(2-morpholin-4-ylethyl)indole-2-carboxamide
CID 110849661

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-1-methyl-N-[(1-propylpiperidin-4-yl)methyl]indole-2-carboxamide?
The IUPAC name of 4-methoxy-1-methyl-N-[(1-propylpiperidin-4-yl)methyl]indole-2-carboxamide (CID 46964195) is 4-methoxy-1-methyl-N-[(1-propylpiperidin-4-yl)methyl]indole-2-carboxamide.
What is the SMILES notation for 4-methoxy-1-methyl-N-[(1-propylpiperidin-4-yl)methyl]indole-2-carboxamide?
The canonical SMILES for 4-methoxy-1-methyl-N-[(1-propylpiperidin-4-yl)methyl]indole-2-carboxamide is CCCN1CCC(CNC(=O)c2cc3c(OC)cccc3n2C)CC1.
What is the InChIKey of 4-methoxy-1-methyl-N-[(1-propylpiperidin-4-yl)methyl]indole-2-carboxamide?
The InChIKey is LNXJZVUROMEHCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H29N3O2/c1-4-10-23-11-8-15(9-12-23)14-21-20(24)18-13-16-17(22(18)2)6-5-7-19(16)25-3/h5-7,13,15H,4,8-12,14H2,1-3H3,(H,21,24).
What are the key properties of 4-methoxy-1-methyl-N-[(1-propylpiperidin-4-yl)methyl]indole-2-carboxamide?
4-methoxy-1-methyl-N-[(1-propylpiperidin-4-yl)methyl]indole-2-carboxamide has a molecular weight of 343.47 g/mol, XLogP of 3.04, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-1-methyl-N-[(1-propylpiperidin-4-yl)methyl]indole-2-carboxamide is sourced from PubChem (CID 46964195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).