5-chloro-1-propan-2-yl-2-pyridin-4-ylindole

C16H15ClN2 — CID 146604810

IUPAC5-chloro-1-propan-2-yl-2-pyridin-4-ylindole
SMILESCC(C)n1c(-c2ccncc2)cc2cc(Cl)ccc21
InChIInChI=1S/C16H15ClN2/c1-11(2)19-15-4-3-14(17)9-13(15)10-16(19)12-5-7-18-8-6-12/h3-11H,1-2H3
InChIKeyHNHAFIPEZWRQNF-UHFFFAOYSA-N
MW270.76 g/mol
LogP4.94
Rot. Bonds2

About 5-chloro-1-propan-2-yl-2-pyridin-4-ylindole

5-chloro-1-propan-2-yl-2-pyridin-4-ylindole (PubChem CID 146604810) has the molecular formula C16H15ClN2 and a molecular weight of 270.76 g/mol. Its IUPAC name is 5-chloro-1-propan-2-yl-2-pyridin-4-ylindole.

Molecular Properties

Compound Name5-chloro-1-propan-2-yl-2-pyridin-4-ylindole
PubChem CID146604810
Molecular FormulaC16H15ClN2
Molecular Weight270.76 g/mol
Exact Mass270.09
IUPAC Name5-chloro-1-propan-2-yl-2-pyridin-4-ylindole
SMILESCC(C)n1c(-c2ccncc2)cc2cc(Cl)ccc21
InChIInChI=1S/C16H15ClN2/c1-11(2)19-15-4-3-14(17)9-13(15)10-16(19)12-5-7-18-8-6-12/h3-11H,1-2H3
InChIKeyHNHAFIPEZWRQNF-UHFFFAOYSA-N
XLogP4.94
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.76
LogP ≤ 54.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5-chloro-1-propan-2-ylindole-2-carbaldehyde
CID 83917759
5-chloro-2-(1-chloroethyl)-1-(1-pyridin-4-ylethyl)benzimidazole
CID 43667577
2-(5-chloro-1-propan-2-ylindol-2-yl)acetic acid
CID 117121626
4-(3-chloro-5-methyl-1-propan-2-ylpyrrol-2-yl)pyridine
CID 91672383
6-chloro-3-(1-pyridin-4-ylethyl)-1H-benzimidazole-2-thione
CID 43659566
5-chloro-2-(piperidin-1-ylmethyl)-1-propan-2-ylindole
CID 117177143
2-(5-chloro-1-propan-2-ylbenzimidazol-2-yl)propan-2-amine
CID 61266514
5-chloro-2-[(1S)-1-chloroethyl]-1-propan-2-ylbenzimidazole
CID 93258606
1-propan-2-yl-2-[4-(trifluoromethoxy)phenyl]pyrrolo[2,3-c]pyridine
CID 146619131
6-chloro-2-(1-chloroethyl)-1-(1-pyridin-4-ylethyl)benzimidazole
CID 115471085
2-methyl-1-propan-2-yl-5-pyridin-4-ylpyrrole-3-carboxamide
CID 91672285
(5-chloro-1-propan-2-ylindol-2-yl)-piperidin-1-ylmethanone
CID 146604568

Frequently Asked Questions

What is the IUPAC name of 5-chloro-1-propan-2-yl-2-pyridin-4-ylindole?
The IUPAC name of 5-chloro-1-propan-2-yl-2-pyridin-4-ylindole (CID 146604810) is 5-chloro-1-propan-2-yl-2-pyridin-4-ylindole.
What is the SMILES notation for 5-chloro-1-propan-2-yl-2-pyridin-4-ylindole?
The canonical SMILES for 5-chloro-1-propan-2-yl-2-pyridin-4-ylindole is CC(C)n1c(-c2ccncc2)cc2cc(Cl)ccc21.
What is the InChIKey of 5-chloro-1-propan-2-yl-2-pyridin-4-ylindole?
The InChIKey is HNHAFIPEZWRQNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15ClN2/c1-11(2)19-15-4-3-14(17)9-13(15)10-16(19)12-5-7-18-8-6-12/h3-11H,1-2H3.
What are the key properties of 5-chloro-1-propan-2-yl-2-pyridin-4-ylindole?
5-chloro-1-propan-2-yl-2-pyridin-4-ylindole has a molecular weight of 270.76 g/mol, XLogP of 4.94, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-1-propan-2-yl-2-pyridin-4-ylindole is sourced from PubChem (CID 146604810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).