[6-methyl-4-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)-3-pyridinyl]methanol

C23H29N3O — CID 134329940

IUPAC[6-methyl-4-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)-3-pyridinyl]methanol
SMILESCc1cc(-c2[nH]c3ccc(C4CCNCC4)cc3c2C(C)C)c(CO)cn1
InChIInChI=1S/C23H29N3O/c1-14(2)22-20-11-17(16-6-8-24-9-7-16)4-5-21(20)26-23(22)19-10-15(3)25-12-18(19)13-27/h4-5,10-12,14,16,24,26-27H,6-9,13H2,1-3H3
InChIKeyDGSNADWXRFPIFV-UHFFFAOYSA-N
MW363.51 g/mol
LogP4.62
Rot. Bonds4

About [6-methyl-4-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)-3-pyridinyl]methanol

[6-methyl-4-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)-3-pyridinyl]methanol (PubChem CID 134329940) has the molecular formula C23H29N3O and a molecular weight of 363.51 g/mol. Its IUPAC name is [6-methyl-4-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)-3-pyridinyl]methanol.

Molecular Properties

Compound Name[6-methyl-4-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)-3-pyridinyl]methanol
PubChem CID134329940
Molecular FormulaC23H29N3O
Molecular Weight363.51 g/mol
Exact Mass363.23
IUPAC Name[6-methyl-4-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)-3-pyridinyl]methanol
SMILESCc1cc(-c2[nH]c3ccc(C4CCNCC4)cc3c2C(C)C)c(CO)cn1
InChIInChI=1S/C23H29N3O/c1-14(2)22-20-11-17(16-6-8-24-9-7-16)4-5-21(20)26-23(22)19-10-15(3)25-12-18(19)13-27/h4-5,10-12,14,16,24,26-27H,6-9,13H2,1-3H3
InChIKeyDGSNADWXRFPIFV-UHFFFAOYSA-N
XLogP4.62
TPSA60.94 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.51
LogP ≤ 54.62
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [6-methyl-4-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)-3-pyridinyl]methanol?
The IUPAC name of [6-methyl-4-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)-3-pyridinyl]methanol (CID 134329940) is [6-methyl-4-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)-3-pyridinyl]methanol.
What is the SMILES notation for [6-methyl-4-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)-3-pyridinyl]methanol?
The canonical SMILES for [6-methyl-4-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)-3-pyridinyl]methanol is Cc1cc(-c2[nH]c3ccc(C4CCNCC4)cc3c2C(C)C)c(CO)cn1.
What is the InChIKey of [6-methyl-4-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)-3-pyridinyl]methanol?
The InChIKey is DGSNADWXRFPIFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H29N3O/c1-14(2)22-20-11-17(16-6-8-24-9-7-16)4-5-21(20)26-23(22)19-10-15(3)25-12-18(19)13-27/h4-5,10-12,14,16,24,26-27H,6-9,13H2,1-3H3.
What are the key properties of [6-methyl-4-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)-3-pyridinyl]methanol?
[6-methyl-4-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)-3-pyridinyl]methanol has a molecular weight of 363.51 g/mol, XLogP of 4.62, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [6-methyl-4-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)-3-pyridinyl]methanol is sourced from PubChem (CID 134329940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).