[6-chloro-1-(cyclopropylmethyl)pyrrolo[2,3-b]pyridin-2-yl]-trimethylstannane

C14H19ClN2Sn — CID 156829346

IUPAC[6-chloro-1-(cyclopropylmethyl)pyrrolo[2,3-b]pyridin-2-yl]-trimethylstannane
SMILESC[Sn](C)(C)c1cc2ccc(Cl)nc2n1CC1CC1
InChIInChI=1S/C11H10ClN2.3CH3.Sn/c12-10-4-3-9-5-6-14(11(9)13-10)7-8-1-2-8;;;;/h3-5,8H,1-2,7H2;3*1H3;
InChIKeyLMOHJFXDVXEHOE-UHFFFAOYSA-N
MW369.48 g/mol
LogP3.64
Rot. Bonds3

About [6-chloro-1-(cyclopropylmethyl)pyrrolo[2,3-b]pyridin-2-yl]-trimethylstannane

[6-chloro-1-(cyclopropylmethyl)pyrrolo[2,3-b]pyridin-2-yl]-trimethylstannane (PubChem CID 156829346) has the molecular formula C14H19ClN2Sn and a molecular weight of 369.48 g/mol. Its IUPAC name is [6-chloro-1-(cyclopropylmethyl)pyrrolo[2,3-b]pyridin-2-yl]-trimethylstannane.

Molecular Properties

Compound Name[6-chloro-1-(cyclopropylmethyl)pyrrolo[2,3-b]pyridin-2-yl]-trimethylstannane
PubChem CID156829346
Molecular FormulaC14H19ClN2Sn
Molecular Weight369.48 g/mol
Exact Mass370.03
IUPAC Name[6-chloro-1-(cyclopropylmethyl)pyrrolo[2,3-b]pyridin-2-yl]-trimethylstannane
SMILESC[Sn](C)(C)c1cc2ccc(Cl)nc2n1CC1CC1
InChIInChI=1S/C11H10ClN2.3CH3.Sn/c12-10-4-3-9-5-6-14(11(9)13-10)7-8-1-2-8;;;;/h3-5,8H,1-2,7H2;3*1H3;
InChIKeyLMOHJFXDVXEHOE-UHFFFAOYSA-N
XLogP3.64
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.48
LogP ≤ 53.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [6-chloro-1-(cyclopropylmethyl)pyrrolo[2,3-b]pyridin-2-yl]-trimethylstannane?
The IUPAC name of [6-chloro-1-(cyclopropylmethyl)pyrrolo[2,3-b]pyridin-2-yl]-trimethylstannane (CID 156829346) is [6-chloro-1-(cyclopropylmethyl)pyrrolo[2,3-b]pyridin-2-yl]-trimethylstannane.
What is the SMILES notation for [6-chloro-1-(cyclopropylmethyl)pyrrolo[2,3-b]pyridin-2-yl]-trimethylstannane?
The canonical SMILES for [6-chloro-1-(cyclopropylmethyl)pyrrolo[2,3-b]pyridin-2-yl]-trimethylstannane is C[Sn](C)(C)c1cc2ccc(Cl)nc2n1CC1CC1.
What is the InChIKey of [6-chloro-1-(cyclopropylmethyl)pyrrolo[2,3-b]pyridin-2-yl]-trimethylstannane?
The InChIKey is LMOHJFXDVXEHOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10ClN2.3CH3.Sn/c12-10-4-3-9-5-6-14(11(9)13-10)7-8-1-2-8;;;;/h3-5,8H,1-2,7H2;3*1H3;.
What are the key properties of [6-chloro-1-(cyclopropylmethyl)pyrrolo[2,3-b]pyridin-2-yl]-trimethylstannane?
[6-chloro-1-(cyclopropylmethyl)pyrrolo[2,3-b]pyridin-2-yl]-trimethylstannane has a molecular weight of 369.48 g/mol, XLogP of 3.64, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [6-chloro-1-(cyclopropylmethyl)pyrrolo[2,3-b]pyridin-2-yl]-trimethylstannane is sourced from PubChem (CID 156829346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).