[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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Related Compounds

N-methyl-7-azaindole
CID 583068
2-[2-(6-Chloropyrrolo[2,3-b]pyridin-1-yl)ethyl]decahydropyrido[1,2-a][1,4]diazepine (11)
CID 46239153
4-Chloro-3,7-dimethyl-2-(1-pyrrolidinyl)[1,8]naphthyridine
CID 1234306
1-[2-(2-Chlorophenyl)ethyl]-3-(5-cyclopropylpyrimidin-2-yl)pyrrolo[2,3-b]pyridine
CID 172441633
methyl 6-chloro-1H-pyrrolo[2,3-b]pyridine-1-carboxylate
CID 15013891
2-Chloro-1,4-dimethyl-1h-pyrido[2,3-b]indole
CID 187957
2-chloro-3-methyl-1H-pyrrolo[2,3-b]pyridine
CID 19392586
4-Chloro-1,3,11-triazatricyclo[7.4.0.0,2,7]trideca-2,4,6,8-tetraene
CID 21868746
4-Chloro-5-Methyl-1-(Triisopropylsilyl)-1H-Pyrrolo(2,3-B)Pyridine
CID 24229276
((4-chloro-1H-pyrrolo(2,3-b)pyridin-3-yl)methyl)dimethylamine
CID 58364964
6-(3-Chlorophenyl)-7-methylpyrrolo[2,3-d]pyrimidine-2,4-diamine
CID 134136051
6-Chloro-3-(4-fluorophenyl)-1-methyl-pyrrolo[2,3-b]pyridine
CID 170855644

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).