4-(2,3-dihydro-1H-indol-5-yl)-N-(piperidin-3-ylmethyl)benzamide

C21H25N3O — CID 153360756

IUPAC4-(2,3-dihydro-1H-indol-5-yl)-N-(piperidin-3-ylmethyl)benzamide
SMILESO=C(NCC1CCCNC1)c1ccc(-c2ccc3c(c2)CCN3)cc1
InChIInChI=1S/C21H25N3O/c25-21(24-14-15-2-1-10-22-13-15)17-5-3-16(4-6-17)18-7-8-20-19(12-18)9-11-23-20/h3-8,12,15,22-23H,1-2,9-11,13-14H2,(H,24,25)
InChIKeyRLZAMAWZNMWIBE-UHFFFAOYSA-N
MW335.45 g/mol
LogP3.05
Rot. Bonds4

About 4-(2,3-dihydro-1H-indol-5-yl)-N-(piperidin-3-ylmethyl)benzamide

4-(2,3-dihydro-1H-indol-5-yl)-N-(piperidin-3-ylmethyl)benzamide (PubChem CID 153360756) has the molecular formula C21H25N3O and a molecular weight of 335.45 g/mol. Its IUPAC name is 4-(2,3-dihydro-1H-indol-5-yl)-N-(piperidin-3-ylmethyl)benzamide.

Molecular Properties

Compound Name4-(2,3-dihydro-1H-indol-5-yl)-N-(piperidin-3-ylmethyl)benzamide
PubChem CID153360756
Molecular FormulaC21H25N3O
Molecular Weight335.45 g/mol
Exact Mass335.20
IUPAC Name4-(2,3-dihydro-1H-indol-5-yl)-N-(piperidin-3-ylmethyl)benzamide
SMILESO=C(NCC1CCCNC1)c1ccc(-c2ccc3c(c2)CCN3)cc1
InChIInChI=1S/C21H25N3O/c25-21(24-14-15-2-1-10-22-13-15)17-5-3-16(4-6-17)18-7-8-20-19(12-18)9-11-23-20/h3-8,12,15,22-23H,1-2,9-11,13-14H2,(H,24,25)
InChIKeyRLZAMAWZNMWIBE-UHFFFAOYSA-N
XLogP3.05
TPSA53.16 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.45
LogP ≤ 53.05
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

4-fluoro-N-(piperidin-3-ylmethyl)benzamide;hydrochloride
CID 119462898
N-(piperidin-3-ylmethyl)benzamide;hydrochloride
CID 119461032
2-oxo-N-(piperidin-3-ylmethyl)-1,3-dihydroindole-6-carboxamide
CID 102711450
N-(piperidin-3-ylmethyl)-4-(trifluoromethyl)benzamide
CID 24701631
4-(dimethylamino)-N-(piperidin-3-ylmethyl)benzamide
CID 43329219
4-(phenylcarbamoylamino)-N-(piperidin-3-ylmethyl)benzamide;hydrochloride
CID 119462020
4-(difluoromethylsulfonyl)-N-(piperidin-3-ylmethyl)benzamide
CID 119461851
3-iodo-4-methyl-N-(piperidin-3-ylmethyl)benzamide
CID 119464322
4-N,4-N-diethyl-1-N-(piperidin-3-ylmethyl)benzene-1,4-dicarboxamide;hydrochloride
CID 119463375
N-(piperidin-3-ylmethyl)-4-pyrazol-1-ylbenzamide
CID 119461275
N-[(4-hydroxycyclohexyl)methyl]-1,2,3,4-tetrahydroquinoline-6-carboxamide
CID 106135432
N-(piperidin-3-ylmethyl)-1H-indole-5-carboxamide
CID 55230606

Frequently Asked Questions

What is the IUPAC name of 4-(2,3-dihydro-1H-indol-5-yl)-N-(piperidin-3-ylmethyl)benzamide?
The IUPAC name of 4-(2,3-dihydro-1H-indol-5-yl)-N-(piperidin-3-ylmethyl)benzamide (CID 153360756) is 4-(2,3-dihydro-1H-indol-5-yl)-N-(piperidin-3-ylmethyl)benzamide.
What is the SMILES notation for 4-(2,3-dihydro-1H-indol-5-yl)-N-(piperidin-3-ylmethyl)benzamide?
The canonical SMILES for 4-(2,3-dihydro-1H-indol-5-yl)-N-(piperidin-3-ylmethyl)benzamide is O=C(NCC1CCCNC1)c1ccc(-c2ccc3c(c2)CCN3)cc1.
What is the InChIKey of 4-(2,3-dihydro-1H-indol-5-yl)-N-(piperidin-3-ylmethyl)benzamide?
The InChIKey is RLZAMAWZNMWIBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25N3O/c25-21(24-14-15-2-1-10-22-13-15)17-5-3-16(4-6-17)18-7-8-20-19(12-18)9-11-23-20/h3-8,12,15,22-23H,1-2,9-11,13-14H2,(H,24,25).
What are the key properties of 4-(2,3-dihydro-1H-indol-5-yl)-N-(piperidin-3-ylmethyl)benzamide?
4-(2,3-dihydro-1H-indol-5-yl)-N-(piperidin-3-ylmethyl)benzamide has a molecular weight of 335.45 g/mol, XLogP of 3.05, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,3-dihydro-1H-indol-5-yl)-N-(piperidin-3-ylmethyl)benzamide is sourced from PubChem (CID 153360756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).